SCHEMBL24267267

SCHEMBL24267267

N#Cc1ccc(C[C@H]2CC[C@H](N)CC2)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BCL2A1 Q16548 1/20 0.41
▸ TRPV4 Q9HBA0 1/20 0.40
▸ PGR P06401 8/20 0.40
▸ AR P10275 5/20 0.38
▸ NOS3 P29474 1/20 0.37
▸ NOS1 P29475 1/20 0.37
▸ ADRA1D P25100 1/20 0.37
▸ KCNJ1 P48048 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ IDO1 P14902 1/20 0.35

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
SCHEMBL24267226 0.85 TRPV4 (0.44) TRPV4PGRAR
SCHEMBL24031511 0.85 PGR (0.47) TRPV4PGRAR
SCHEMBL24267357 0.74 TRPV4 (0.38) TRPV4PGRARNOS3NOS1
SCHEMBL31561766 0.74 TRPV4 (0.43) BCL2A1TRPV4PGRARIDO1
SCHEMBL5047623 0.72 TRPV4 (0.52) TRPV4ARNOS3NOS1ADRA1D
SCHEMBL7787351 0.71 TRPV4 (0.55) TRPV4ARNOS3NOS1ADRA1D
SCHEMBL8751343 0.71 IDO1 (0.50) KCNH2IDO1
Hydrochloric Acid SCHEMBL6486656 0.71 TRPV4 (0.50) TRPV4ARNOS3NOS1ADRA1D
SCHEMBL15575031 0.71 PGR (0.62) BCL2A1TRPV4PGRAR
SCHEMBL22565823 0.71 PGR (0.62) BCL2A1TRPV4PGRAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3957633-A1 A CLASS OF BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUNDS FOR TARGETED DEGRADATION OF ANDROGEN RECEPTORS AND USE THEREOF Hinova Pharmaceuticals Inc. (CN) 2022-02-23 — — EP disclosed
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