SCHEMBL422282

SCHEMBL422282

Cc1ccc2cccc(C(N)=O)c2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 9/20 1.00
METAP2 P50579 1/20 0.55
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
CD38 P28907 5/20 0.49
CCR1 P32246 1/20 0.48
RAB9A P51151 1/20 0.48
CCR5 P51681 1/20 0.48
CYP3A4 P08684 2/20 0.47
KCNH2 Q12809 1/20 0.47

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
SCHEMBL29923839 1.00 PARP1 (1.00) PARP1METAP2GAAMAPTCD38
SCHEMBL29831069 0.85 PARP1 (0.74) PARP1METAP2GAAMAPTCD38
SCHEMBL28154259 0.85 PARP1 (0.74) PARP1METAP2GAAMAPTCD38
SCHEMBL27772010 0.84 PARP1 (0.72) PARP1METAP2GAAMAPTCD38
SCHEMBL5319765 0.84 PARP1 (0.72) PARP1METAP2GAAMAPTCD38
SCHEMBL29412561 0.84 PARP1 (0.72) PARP1METAP2GAAMAPTCD38
SCHEMBL29400398 0.82 PARP1 (0.70) PARP1METAP2GAAMAPTCD38
SCHEMBL5149194 0.82 PARP1 (0.70) PARP1METAP2GAAMAPTCD38
SCHEMBL21816896 0.82 PARP1 (0.70) PARP1METAP2GAAMAPTCD38
SCHEMBL27945296 0.82 PARP1 (0.70) PARP1METAP2GAAMAPTCD38

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3169325-A1 THERAPEUTIC INHIBITORY COMPOUNDS Lifesci Pharmaceuticals, Inc. (BB) 2017-05-24 EP claimed
WO-2016011209-A1 THERAPEUTIC INHIBITORY COMPOUNDS LIFESCI PHARMACEUTICALS, INC. (BB) 2016-01-21 WO claimed
US-20120022026-A1 METHOD OF TREATING CANCER ERASMUS UNIVERSITY MEDICAL CENTER ROTTERDAM (NL) 2012-01-26 US claimed
CN-102316869-A The treatment method for cancer AMC AMSTERDAM 2012-01-11 CN claimed
EP-2387403-A1 METHOD OF TREATING CANCER Academisch Medisch Centrum bij de Universiteit van Amsterdam (NL) 2011-11-23 EP claimed
US-20110253692-A1 Electrical heater for vehicle windshields and windows SCHAUBLE RICHARD EGON 2011-10-20 US claimed
WO-2010082821-A1 METHOD OF TREATING CANCER ACADEMISCH MEDISCH CENTRUM BIJ DE UNIVERSITEIT VAN AMSTERDAM (NL) 2010-07-22 WO claimed
US-20240105279-A1 METHODS AND SYSTEMS EMPLOYING TARGETED NEXT GENERATION SEQUENCING FOR CLASSIFYING A TUMOR SAMPLE AS HAVING A LEVEL OF HOMOLOGOUS RECOMBINATION DEFICIENCY SIMILAR TO THAT ASSOCIATED WITH MUTATIONS IN BRCA1 OR BRCA2 GENES Genomic Testing Cooperative, LCA (US) 2024-03-28 US disclosed
WO-2023039170-A1 SELECTIVE TARGETING OF CD38 ACTIVITY AS AN IMMUNOSTIMULATORY AND ANTITUMOR STRATEGY MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2023-03-16 WO disclosed
US-11278530-B2 Polycyclic amides as muscarinic M1 receptor positive allosteric modulators SUVEN LIFE SCIENCES LIMITED (IN) 2022-03-22 US disclosed
EP-3700895-A1 POLYCYCLIC AMIDES AS MUSCARINIC M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS Suven Life Sciences Limited (IN) 2020-09-02 EP disclosed
CN-105164119-B 5-amino-quinoline-8-carboxamide derivatives as 5-HT4 receptor agonists 苏文生命科学有限公司 2017-12-08 CN disclosed
EP-3169325-A1 THERAPEUTIC INHIBITORY COMPOUNDS Lifesci Pharmaceuticals, Inc. (BB) 2017-05-24 EP disclosed
CN-102199173-B 2-benzimidazolyl-8-methanamide quinoline chromium complexes, preparation method and application thereof CHINESE ACAD INST CHEMISTRY 2012-09-26 CN disclosed
US-20120022026-A1 METHOD OF TREATING CANCER ERASMUS UNIVERSITY MEDICAL CENTER ROTTERDAM (NL) 2012-01-26 US disclosed
CN-102316869-A The treatment method for cancer AMC AMSTERDAM 2012-01-11 CN disclosed
EP-2387403-A1 METHOD OF TREATING CANCER Academisch Medisch Centrum bij de Universiteit van Amsterdam (NL) 2011-11-23 EP disclosed
US-20110253692-A1 Electrical heater for vehicle windshields and windows SCHAUBLE RICHARD EGON 2011-10-20 US disclosed
CN-102199173-A 2-benzimidazolyl-8-methanamide quinoline chromium complexes, its preparation method and application CHINESE ACAD INST CHEMISTRY 2011-09-28 CN disclosed
WO-2010082821-A1 METHOD OF TREATING CANCER ACADEMISCH MEDISCH CENTRUM BIJ DE UNIVERSITEIT VAN AMSTERDAM (NL) 2010-07-22 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 (1 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-11278530-B2 Polycyclic amides as muscarinic M1 receptor positive allosteric modulators CHRM1, CHRM2, CHRM5 PARP1 2034/4885METAP2 2543/4885GAA 3871/4885

“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.