SCHEMBL30525290

SCHEMBL30525290

OCCc1cccc(C(F)(F)F)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.67
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
ACP3 P15309 1/20 0.56
MIF P14174 2/20 0.56
IDO1 P14902 2/20 0.55
HTR2A P28223 1/20 0.53
HTR2C P28335 1/20 0.53
HTR2B P41595 1/20 0.53
HDAC1 Q13547 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
DAO P14920 1/20 0.50
PRKCA P17252 1/20 0.49
PRKCD Q05655 1/20 0.49
GAA P10253 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
NR3C2 P08235 1/20 0.48
MAPT P10636 1/20 0.47
GRIN2B Q13224 1/20 0.47

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
SCHEMBL156739 1.00 TAAR1 (0.67) TAAR1MEN1KMT2AACP3MIF
SCHEMBL16399450 0.89 TAAR1 (0.54) TAAR1MEN1KMT2AACP3MIF
SCHEMBL81305 0.89 TAAR1 (0.62) TAAR1MEN1KMT2AACP3MIF
SCHEMBL1044827 0.87 TAAR1 (0.61) TAAR1MEN1KMT2AACP3MIF
Bromide SCHEMBL28093819 0.87 TAAR1 (0.61) TAAR1MEN1KMT2AACP3MIF
SCHEMBL2952807 0.85 TAAR1 (0.59) TAAR1MEN1KMT2AACP3MIF
SCHEMBL1047618 0.85 TAAR1 (0.59) TAAR1MEN1KMT2AACP3MIF
SCHEMBL23343817 0.85 TAAR1 (0.49) TAAR1MEN1KMT2AACP3MIF
SCHEMBL2257 0.83 TAAR1 (0.60) TAAR1MEN1KMT2AACP3MIF
SCHEMBL15737961 0.83 TAAR1 (0.61) TAAR1MEN1KMT2AACP3MIF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116535607-A Polymer, process for producing the same, and liquid film deicing material 中国民用航空飞行学院 2023-08-04 CN claimed
CN-117447468-A Bazedoxifene derivative and preparation method and application thereof 中国药科大学 2024-01-26 CN disclosed
CN-116535607-A Polymer, process for producing the same, and liquid film deicing material 中国民用航空飞行学院 2023-08-04 CN disclosed