SCHEMBL24969554

SCHEMBL24969554

NC1CC(=O)c2ccccc2O1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.61
ADORA3 P0DMS8 3/20 0.61
AR P10275 2/20 0.61
KDM4E B2RXH2 1/20 0.61
CYP19A1 P11511 1/20 0.61
HSD17B10 Q99714 1/20 0.61
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
MAPT P10636 2/20 0.53
HSD11B1 P28845 1/20 0.53
AKR1C3 P42330 1/20 0.53
CYP3A4 P08684 1/20 0.53
MAPK1 P28482 1/20 0.53
AXL P30530 1/20 0.49
SIGMAR1 Q99720 2/20 0.44
ABCB1 P08183 1/20 0.44
S100A4 P26447 1/20 0.44
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42

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
SCHEMBL8373024 0.78 MAOB (0.62) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL10344116 0.78 MAOB (0.62) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL8185206 0.77 MAOB (0.61) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL9819236 0.77 MAOB (0.61) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL27956971 0.77 MAOB (0.61) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL30274254 0.77 MAOB (0.61) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL8043472 0.77 MAOB (0.61) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL15147107 0.77 MAOB (0.61) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL69392 0.77 MAOB (0.61) MAOBADORA3ARKDM4ECYP19A1
SCHEMBL7361033 0.77 MAOB (0.61) MAOBADORA3ARKDM4ECYP19A1

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