SCHEMBL24496405

SCHEMBL24496405

Cc1ccc2c(n1)C1(CCCC1)C(=O)N2

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 8/20 0.41
▸ PDE4A P27815 4/20 0.39
▸ PDE4B Q07343 4/20 0.39
▸ PDE4C Q08493 4/20 0.39
▸ PDE4D Q08499 4/20 0.39
▸ PDE3B Q13370 4/20 0.39
▸ PDE3A Q14432 4/20 0.39
▸ PGR P06401 8/20 0.38

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
SCHEMBL29596832 1.00 MAPK14 (0.41) MAPK14PDE4APDE4BPDE4CPDE4D
SCHEMBL24496419 0.98 MAPK14 (0.40) MAPK14PDE4APDE4BPDE4CPDE4D
SCHEMBL29596945 0.98 MAPK14 (0.40) MAPK14PDE4APDE4BPDE4CPDE4D
SCHEMBL29597305 0.97 MAPK14 (0.41) MAPK14PDE4APDE4BPDE4CPDE4D
SCHEMBL24496411 0.97 MAPK14 (0.41) MAPK14PDE4APDE4BPDE4CPDE4D
SCHEMBL24496560 0.95 MAPK14 (0.36) MAPK14PDE4APDE4BPDE4CPDE4D
SCHEMBL29596629 0.95 MAPK14 (0.36) MAPK14PDE4APDE4BPDE4CPDE4D
SCHEMBL23778395 0.89 MEN1 (0.36) MAPK14PDE4APDE4BPDE4CPDE4D
SCHEMBL24496403 0.87 MAPK14 (0.43) MAPK14
SCHEMBL24496551 0.82 MAPK14 (0.34) MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4257584-A1 2,3-DIHYDRO-1H-PYRROLO[3,2-B]PYRIDINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF Abbisko Therapeutics Co., Ltd. (CN) 2023-10-11 — — EP disclosed
WO-2022116995-A1 2,3-DIHYDRO-1H-PYRROLO[3,2-B]PYRIDINE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 上海和誉生物医药科技有限公司 2022-06-09 — — WO disclosed
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