SCHEMBL1573740

SCHEMBL1573740

CNC1CC2CCC(C1)N2C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
CYP2C9 P11712 1/20 0.50
SLC6A2 P23975 5/20 0.43
CHRM1 P11229 4/20 0.43
SLC6A4 P31645 4/20 0.43
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HTR3E A5X5Y0 1/20 0.37
HTR3B O95264 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRNB2 P17787 1/20 0.37
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
HRH1 P35367 1/20 0.37
CHRNA7 P36544 1/20 0.37
CHRNA4 P43681 1/20 0.37
HTR3A P46098 1/20 0.37
TMEM97 Q5BJF2 1/20 0.37
HTR3D Q70Z44 1/20 0.37

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
SCHEMBL18502846 1.00 LMNA (0.50) LMNACYP2C9SLC6A2CHRM1SLC6A4
SCHEMBL25474174 1.00 LMNA (0.50) LMNACYP2C9SLC6A2CHRM1SLC6A4
SCHEMBL1573739 1.00 LMNA (0.50) LMNACYP2C9SLC6A2CHRM1SLC6A4
SCHEMBL3582332 0.90 HTR3E (0.46) LMNACYP2C9SLC6A2CHRM1SLC6A4
SCHEMBL9381779 0.90 HTR3E (0.46) LMNACYP2C9SLC6A2CHRM1SLC6A4
SCHEMBL13778750 0.86 LMNA (0.40) LMNACYP2C9SLC6A2CHRM1SLC6A4
SCHEMBL15444631 0.80 HTR3A (0.34) LMNACYP2C9HTR3A
SCHEMBL20715143 0.80 LMNA (0.46) LMNACYP2C9SLC6A2CHRM1SLC6A4
SCHEMBL3408333 0.79 MEN1 (0.38) MEN1KMT2A
SCHEMBL3411137 0.78 HTR4 (0.31) LMNACYP2C9HTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11795147-B2 Modulators of complex I BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2023-10-24 US disclosed
WO-2022166920-A1 PYRROLOPYRIDAZINE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 杭州中美华东制药有限公司 2022-08-11 WO disclosed
US-20220024907-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2022-01-27 US disclosed
WO-2021026451-A1 COMPOUNDS AND METHOD FOR TREATING CYTOKINE RELEASE SYNDROME RIGEL PHARMACEUTICALS, INC. (US) 2021-02-11 WO disclosed
US-20200216431-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2020-07-09 US disclosed
EP-3617221-A1 CYTOTOXIN AND CONJUGATE, USES OF SAME, AND PREPARATION METHOD THEREFOR Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) 2020-03-04 EP disclosed
US-10556891-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2020-02-11 US disclosed
US-10479783-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2019-11-19 US disclosed
US-10005767-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2018-06-26 US disclosed
US-20180162848-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2018-06-14 US disclosed
US-7186724-B2 Heterocyclic substituted carbonyl derivatives and their use as dopamine D3 receptor ligands AVENTIS PHARMACEUTICALS INC. (US) 2007-03-06 US disclosed
US-7186724-B2 Heterocyclic substituted carbonyl derivatives and their use as dopamine D3 receptor ligands AVENTIS PHARMACEUTICALS INC. (US) 2007-03-06 US disclosed
WO-2006135715-A1 BENZTROPINAMINE ANALOGS AS DOPAMINE UPTAKE INHIBITORS GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2006-12-21 WO disclosed
EP-0085893-B1 PYRIDOBENZODIAZEPINONES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Dr. Karl Thomae GmbH (DE) 1986-05-14 EP disclosed
US-4443452-A ANTIULCER AGENTS DR. KARL THOMAE GMBH (DE) 1984-04-17 US disclosed
US-4424222-A ANTIULCER AND ANTISECRETORY AGENTS KARL THOMAE GMBH (DE) 1984-01-03 US disclosed
US-4410527-A ANTIULCER AGENTS DR. KARL THOMAE GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1983-10-18 US disclosed
EP-0086980-A1 Substituted dibenzodiazepinones, process for their preparation and medicines containing these compounds Dr. Karl Thomae GmbH (DE) 1983-08-31 EP disclosed
EP-0086981-A1 Substituted thienobenzodiazepinones, process for their preparation and medicines containing these compounds Dr. Karl Thomae GmbH (DE) 1983-08-31 EP disclosed
EP-0085893-A2 Pyridobenzodiazepinones, process for their preparation and pharmaceutical compositions containing them Dr. Karl Thomae GmbH (DE) 1983-08-17 EP 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 (7 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-20180162848-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 LMNA 3908/4885CYP2C9 2253/4885SLC6A2 4839/4885
US-20200216431-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 LMNA 3892/4885CYP2C9 2743/4885SLC6A2 4861/4885
US-10479783-B2 Compositions and methods for inhibition of the JAK pathway JAK3, JAK2, JAK1 LMNA 3908/4885CYP2C9 2253/4885SLC6A2 4839/4885
US-10556891-B2 Compositions and methods for inhibition of the JAK pathway JAK3, JAK2, JAK1 LMNA 3892/4885CYP2C9 2743/4885SLC6A2 4861/4885
US-10005767-B2 Compositions and methods for inhibition of the JAK pathway JAK3, JAK2, JAK1 LMNA 3892/4885CYP2C9 2743/4885SLC6A2 4861/4885
US-11795147-B2 Modulators of complex I NDUFAB1, NDUFV1, NDUFB7 LMNA 3295/4885CYP2C9 781/4885SLC6A2 3156/4885
US-20220024907-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 LMNA 3908/4885CYP2C9 2253/4885SLC6A2 4839/4885

“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.