SCHEMBL28656259

SCHEMBL28656259

Cc1cc(Cc2cccc(C(F)(F)F)c2)cc(C)c1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.53
HTR2B P41595 2/20 0.53
HTR2C P28335 1/20 0.53
TAAR1 Q96RJ0 1/20 0.51
IDO1 P14902 2/20 0.50
LTA4H P09960 1/20 0.49
MAOB P27338 2/20 0.47
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
DAO P14920 1/20 0.44
MPO P05164 1/20 0.44
ACP3 P15309 1/20 0.44
ROCK1 Q13464 1/20 0.44
SIGMAR1 Q99720 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL28904169 0.84 IDO1 (0.46) HTR2AHTR2BHTR2CTAAR1IDO1
SCHEMBL3237564 0.82 TAAR1 (0.64) HTR2AHTR2BHTR2CTAAR1IDO1
SCHEMBL28379126 0.81 LTA4H (0.45) TAAR1IDO1LTA4HMAOB
SCHEMBL4329443 0.79 MAOB (0.68) IDO1MAOBMAPT
SCHEMBL25825120 0.78 HTR2A (0.45) HTR2AHTR2BHTR2CTAAR1IDO1
SCHEMBL21165039 0.78 MAPT (0.58) HTR2AHTR2BHTR2CTAAR1IDO1
SCHEMBL4977397 0.78 MAOB (0.62) HTR2AHTR2BHTR2CTAAR1IDO1
SCHEMBL20036156 0.77 HTR2A (0.49) HTR2AHTR2BHTR2CTAAR1IDO1
SCHEMBL22897958 0.77 HTR2A (0.49) HTR2AHTR2BHTR2CTAAR1IDO1
SCHEMBL29559521 0.77 HTR2A (0.49) HTR2AHTR2BHTR2CTAAR1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113698600-A Soluble polyimide resin, preparation method, patternable polyimide fiber and application 波米科技有限公司 2021-11-26 CN claimed
CN-113698600-A Soluble polyimide resin, preparation method, patternable polyimide fiber and application 波米科技有限公司 2021-11-26 CN disclosed