SCHEMBL25825120

SCHEMBL25825120

Cc1cccc(Cc2cc(C)cc(C(F)(F)F)c2)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
HTR2B P41595 1/20 0.45
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
CETP P11597 1/20 0.44
TAAR1 Q96RJ0 2/20 0.43
IDO1 P14902 4/20 0.42
TACR1 P25103 1/20 0.42
MAPT P10636 1/20 0.41
DAO P14920 2/20 0.41
PPARG P37231 1/20 0.40
NFE2L2 Q16236 1/20 0.40
ACP3 P15309 1/20 0.40
LTA4H P09960 1/20 0.40

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
SCHEMBL14570493 0.87 IDO1 (0.43) HTR2AHTR2CHTR2BTAAR1IDO1
SCHEMBL18738751 0.86 PTPN2 (0.47) HTR2AHTR2CHTR2BPTPN2PTPN1
SCHEMBL16767879 0.85 GRIN2B (0.44) HTR2AHTR2CHTR2BTAAR1IDO1
SCHEMBL25050107 0.81 IDH1 (0.53) TAAR1IDO1DAOPPARGLTA4H
SCHEMBL29459538 0.80 TAAR1 (0.60) TAAR1IDO1DAOLTA4H
SCHEMBL1263547 0.80 TAAR1 (0.60) TAAR1IDO1DAOLTA4H
SCHEMBL30000562 0.80 TAAR1 (0.60) TAAR1IDO1DAOLTA4H
SCHEMBL18164547 0.80 TAAR1 (0.62) HTR2AHTR2CHTR2BCETPTAAR1
SCHEMBL18002661 0.79 MAPT (0.46) HTR2AHTR2CHTR2BTAAR1IDO1
SCHEMBL21165039 0.79 MAPT (0.58) HTR2AHTR2CHTR2BTAAR1IDO1

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-2023125737-A1 HETEROCYCLIC COMPOUNDS AND USE THEREOF SILEXON AI TECHNOLOGY CO., LTD. (CN) 2023-07-06 WO disclosed