SCHEMBL26617995

SCHEMBL26617995

Cc1c(C(=O)O)c(N2CCCC(F)(F)CC2)nc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 5/20 0.45
▸ PDE10A Q9Y233 1/20 0.45
▸ FABP3 P05413 1/20 0.43
▸ FABP4 P15090 1/20 0.43
▸ FABP5 Q01469 1/20 0.43
▸ MGLL Q99685 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SCN10A Q9Y5Y9 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ ATM Q13315 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ CTDSP1 Q9GZU7 1/20 0.41

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
SCHEMBL26617902 0.85 MAOB (0.46) MAOBKDM4E
SCHEMBL26617776 0.80 MAOB (0.43) MAOBMGLLSCN10AKDM4EATM
SCHEMBL30681915 0.80 MAPT (0.46) MAOBMGLLSCN10AKDM4EMAPK1
SCHEMBL26617552 0.80 MAPT (0.46) MAOBMGLLSCN10AKDM4EMAPK1
SCHEMBL25390781 0.79 SMO (0.42) PDE10AFABP3FABP4FABP5MEN1
SCHEMBL30562668 0.79 SMO (0.42) PDE10AFABP3FABP4FABP5MEN1
SCHEMBL26617640 0.79 SCN10A (0.58) SCN10A
SCHEMBL25388945 0.78 SCN10A (0.59) SCN10A
SCHEMBL25388342 0.78 SCN10A (0.45) SCN10A
SCHEMBL31440829 0.78 SCN10A (0.59) SCN10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119585247-A Bicyclic heterocyclic amide inhibitors of nav1.8 for the treatment of pain 赛特温治疗公司 2025-03-07 — — CN disclosed
EP-4514789-A1 <SUP2/>? <SUB2/>?V?BICYCLIC HETEROCYCLIC AMIDE INHIBITORS OF NA1.8 FOR THE TREATMENT OF PAIN SiteOne Therapeutics, Inc. (US) 2025-03-05 — — EP disclosed
WO-2023211990-A1 BICYCLIC HETEROCYCLIC AMIDE INHIBITORS OF NA V1.8 FOR THE TREATMENT OF PAIN SITEONE THERAPEUTICS, INC. (US) 2023-11-02 — — WO disclosed
WO-2023211990-A1 BICYCLIC HETEROCYCLIC AMIDE INHIBITORS OF NA V1.8 FOR THE TREATMENT OF PAIN SITEONE THERAPEUTICS, INC. (US) 2023-11-02 — — WO disclosed
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