SCHEMBL19260828

SCHEMBL19260828

CNc1c2ccccc2nc2cc(OCCCN3CCCC3)ccc12

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 15/20 0.54
KCNH2 Q12809 9/20 0.54
ADRA1A P35348 4/20 0.54
CACNA2D1 P54289 1/20 0.53
ACHE P22303 1/20 0.52
HTR3A P46098 1/20 0.52
ACP1 P24666 1/20 0.51
TLR9 Q9NR96 1/20 0.51
XDH P47989 1/20 0.50

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
Formic Acid SCHEMBL20720694 0.94 HRH3 (0.52) HRH3KCNH2ADRA1AACHEHTR3A
SCHEMBL19260636 0.85 HRH3 (0.56) HRH3KCNH2ADRA1AACP1TLR9
SCHEMBL19260720 0.85 HRH3 (0.54) HRH3KCNH2ADRA1AACP1TLR9
SCHEMBL19260661 0.84 SRC (0.57) HRH3KCNH2ADRA1ACACNA2D1ACHE
SCHEMBL19260540 0.83 ACP1 (0.53) HRH3KCNH2ADRA1ACACNA2D1ACP1
SCHEMBL19260598 0.83 ACP1 (0.53) HRH3CACNA2D1ACP1TLR9
SCHEMBL19260688 0.83 EHMT2 (0.56) ACP1TLR9
SCHEMBL19260613 0.83 ACP1 (0.53) HRH3CACNA2D1ACP1TLR9
SCHEMBL20720605 0.82 SPIN1 (0.56) HRH3ACP1TLR9
SCHEMBL20720695 0.81 HRH3 (0.47) HRH3KCNH2ADRA1ACACNA2D1ACHE

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3416963-B1 HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS INC (US) 2021-07-28 EP claimed
US-20190047981-A1 HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. 2019-02-14 US claimed
EP-3416963-A1 HISTONE METHYLTRANSFERASE INHIBITORS Global Blood Therapeutics, Inc. (US) 2018-12-26 EP claimed
WO-2017142947-A1 HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2017-08-24 WO claimed
US-11584734-B2 Tricyclic compounds as histone methyltransferase inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2023-02-21 US disclosed
EP-3416963-B1 HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS INC (US) 2021-07-28 EP disclosed
US-20200361896-A1 TRICYCLIC COMPOUNDS AS HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. 2020-11-19 US 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 (3 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-20190047981-A1 HISTONE METHYLTRANSFERASE INHIBITORS EHMT1, EHMT2, BMI1 HRH3 1038/4885KCNH2 2770/4885ADRA1A 3721/4885
US-11584734-B2 Tricyclic compounds as histone methyltransferase inhibitors EHMT1, EHMT2, BMI1 HRH3 1063/4885KCNH2 1383/4885ADRA1A 3426/4885
US-20200361896-A1 TRICYCLIC COMPOUNDS AS HISTONE METHYLTRANSFERASE INHIBITORS EHMT1, EHMT2, BMI1 HRH3 1063/4885KCNH2 1383/4885ADRA1A 3426/4885

“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.