SCHEMBL23891752

SCHEMBL23891752

Cc1ccc(C2CCC(C(C)(C)F)=N2)cc1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.32
PRKCZ Q05513 1/20 0.32
CYP19A1 P11511 2/20 0.31
PRCP P42785 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
RIPK1 Q13546 1/20 0.31
THRB P10828 1/20 0.30

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
SCHEMBL23891653 0.77 GSK3B (0.36) PRKCZPRCPHTR2AHTR2CHTR2B
SCHEMBL22039450 0.72 GSK3B (0.37) PRCP
SCHEMBL23878327 0.72 GSK3B (0.37) PRCP
SCHEMBL23054751 0.70 NOS1 (0.46) PDE5AHTR2CRIPK1
SCHEMBL38651941 0.70 MAOB (0.39)
SCHEMBL14540777 0.67 NOS3 (0.40)
SCHEMBL6310815 0.65 ACHE (0.40) CYP19A1HTR2AHTR2CHTR2BTHRB
SCHEMBL13944940 0.64 NOS3 (0.37)
SCHEMBL13906325 0.62 SLC18A3 (0.40) HTR2C
SCHEMBL13906324 0.62 SLC18A3 (0.40) HTR2C

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-3889138-A1 HISTONE ACETYLASE P300 INHIBITOR AND USE THEREOF Hinova Pharmaceuticals Inc. (CN) 2021-10-06 EP disclosed