SCHEMBL30152308

SCHEMBL30152308

Nc1ccc(C2CCc3ccccc3C2)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.42
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
PIK3CG P48736 1/20 0.38
PRKDC P78527 1/20 0.38
ANPEP P15144 1/20 0.37
HTR6 P50406 3/20 0.37
MAPT P10636 3/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 2/20 0.37
MAPK1 P28482 1/20 0.37
GFER P55789 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GRIN2B Q13224 2/20 0.37
DRD2 P14416 1/20 0.36
DRD3 P35462 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
TRPV3 Q8NET8 1/20 0.34

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
SCHEMBL24968850 1.00 PLAU (0.42) PLAUPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL30084892 0.76 CHRNB2 (0.41) MAPTALDH1A1LMNAMAPK1GFER
SCHEMBL13014935 0.76 CHRNB2 (0.41) MAPTALDH1A1LMNAMAPK1GFER
SCHEMBL24969071 0.75 NISCH (0.43) LMNANPC1RAB9ASMN1; SMN2
SCHEMBL30152236 0.75 NISCH (0.43) LMNANPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL287323 0.75 CHRNB2 (0.40) MAPTALDH1A1LMNAMAPK1GFER
SCHEMBL12474593 0.74 CRBN (0.40)
SCHEMBL21988069 0.73 ALOX5AP (0.40) ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL26131159 0.73 OPRL1 (0.41) MAPTALDH1A1GFERKDM4ENPC1
SCHEMBL240676 0.72 NUDT1 (0.42) MAPTALDH1A1GFERKDM4ENPC1

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
WO-2023009785-A1 TEAD INHIBITORS AND USES THEREOF CEDILLA THERAPEUTICS, INC. (US) 2023-02-02 WO disclosed