SCHEMBL18341338

SCHEMBL18341338

O=C(Nc1c(Cl)cccc1Cl)c1cc(Cl)ccc1O

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ P2RX1 P51575 12/20 0.68
▸ P2RX4 Q99571 4/20 0.68
▸ P2RX7 Q99572 4/20 0.68
▸ TMPRSS4 Q9NRS4 5/20 0.65
▸ KCNMA1 Q12791 5/20 0.64
▸ SLC2A1 P11166 1/20 0.57

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30771722 1.00 P2RX1 (0.68) P2RX1P2RX4P2RX7TMPRSS4KCNMA1
SCHEMBL1704851 0.87 TMPRSS4 (0.67) P2RX1P2RX4P2RX7TMPRSS4KCNMA1
SCHEMBL10223864 0.85 P2RX1 (0.65) P2RX1P2RX4P2RX7TMPRSS4KCNMA1
SCHEMBL18341307 0.84 P2RX1 (0.64) P2RX1P2RX4P2RX7TMPRSS4KCNMA1
SCHEMBL30771732 0.84 P2RX1 (0.64) P2RX1P2RX4P2RX7TMPRSS4KCNMA1
SCHEMBL24460167 0.84 P2RX1 (0.71) P2RX1P2RX4P2RX7TMPRSS4KCNMA1
SCHEMBL16147455 0.83 KCNMA1 (0.71) P2RX1P2RX4P2RX7TMPRSS4KCNMA1
SCHEMBL31093979 0.83 KCNMA1 (0.71) P2RX1P2RX4P2RX7TMPRSS4KCNMA1
SCHEMBL330391 0.81 P2RX1 (0.66) P2RX1P2RX4P2RX7TMPRSS4KCNMA1
SCHEMBL11932152 0.81 P2RX1 (1.00) P2RX1P2RX4P2RX7TMPRSS4KCNMA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240002332-A1 Small Molecule Inhibitors of SARS-CoV-2 Infections THE FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION 2024-01-04 — — US claimed
US-20200038350-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE DUKE UNIVERSITY 2020-02-06 — — US claimed
EP-3313388-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE Duke University (US) 2018-05-02 — — EP claimed
WO-2016210289-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE DUKE UNIVERSITY (US) 2016-12-29 — — WO claimed
US-20240002332-A1 Small Molecule Inhibitors of SARS-CoV-2 Infections THE FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION 2024-01-04 — — US disclosed
US-11793777-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FIRST WAVE BIO, INC. (US) 2023-10-24 — — US disclosed
US-11793777-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FIRST WAVE BIO, INC. (US) 2023-10-24 — — US disclosed
WO-2022109148-A1 SMALL MOLECULE INHIBITORS OF SARS-COV-2 INFECTIONS THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES (US) 2022-05-27 — — WO disclosed
US-20220000812-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSES FIRST WAVE BIO, INC. 2022-01-06 — — US disclosed
US-20210401784-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSE FIRST WAVE BIO, INC. 2021-12-30 — — US disclosed
US-10912746-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FIRST WAVE BIO, INC. (US) 2021-02-09 — — US disclosed
US-10905665-B2 Chemical modulators of signaling pathways and therapeutic use DUKE UNIVERSITY (US) 2021-02-02 — — US disclosed
US-20200038350-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE DUKE UNIVERSITY 2020-02-06 — — US disclosed
US-20190298670-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSES MONTERESEARCH S.R.L. (IT) 2019-10-03 — — US disclosed
US-10292951-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory responses FIRST WAVE BIO, INC. (US) 2019-05-21 — — US disclosed
EP-3313388-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE Duke University (US) 2018-05-02 — — EP disclosed
WO-2017040864-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSES First Wave Biopharma (US) 2017-03-09 — — WO disclosed
US-20170056347-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSES FIRST WAVE BIO, INC. 2017-03-02 — — US disclosed
US-20170056347-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSES FIRST WAVE BIO, INC. 2017-03-02 — — US disclosed
WO-2016210289-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE DUKE UNIVERSITY (US) 2016-12-29 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210401784-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSE FH, CS, ECHS1 P2RX1 910/4885P2RX4 694/4885P2RX7 285/4885
US-20240002332-A1 Small Molecule Inhibitors of SARS-CoV-2 Infections ACE2, ACE, TMPRSS2 P2RX1 2669/4885P2RX4 3287/4885P2RX7 2285/4885
US-20190298670-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSES FH, CS, ECHS1 P2RX1 848/4885P2RX4 655/4885P2RX7 271/4885
US-10292951-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory responses FH, CS, ECHS1 P2RX1 848/4885P2RX4 655/4885P2RX7 271/4885
US-10912746-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FH, CS, ECHS1 P2RX1 901/4885P2RX4 686/4885P2RX7 288/4885
US-20200038350-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE SFRP1, FZD7, WNT1 P2RX1 3423/4885P2RX4 3784/4885P2RX7 2757/4885
US-20170056347-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSES FH, CS, ECHS1 P2RX1 848/4885P2RX4 655/4885P2RX7 271/4885
US-20220000812-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSES FH, CS, ECHS1 P2RX1 848/4885P2RX4 655/4885P2RX7 271/4885
US-10905665-B2 Chemical modulators of signaling pathways and therapeutic use SFRP1, FZD7, WNT1 P2RX1 3423/4885P2RX4 3784/4885P2RX7 2757/4885
US-11793777-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FH, CS, ECHS1 P2RX1 910/4885P2RX4 694/4885P2RX7 285/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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