SCHEMBL28895998

SCHEMBL28895998

NC(=O)c1ccc(C(=O)Nc2cc(C(F)(F)F)c(N)cc2C(F)(F)F)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C19 P33261 1/20 0.52
RAB9A P51151 1/20 0.52
PTGS1 P23219 5/20 0.50
HDAC1 Q13547 6/20 0.49
HDAC8 Q9BY41 2/20 0.49
HDAC6 Q9UBN7 2/20 0.49
P2RY14 Q15391 2/20 0.44
HDAC2 Q92769 3/20 0.44
MAPT P10636 1/20 0.41
XBP1 P17861 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HDAC3 O15379 2/20 0.40
BRAF P15056 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC9 Q9UKV0 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
SCHEMBL28255136 0.83 CYP1A2 (0.59) CYP1A2CYP2D6CYP2C19RAB9APTGS1
SCHEMBL28895734 0.80 MAPT (0.57) RAB9APTGS1HDAC1HDAC8HDAC6
SCHEMBL26416602 0.76 CYP1A2 (0.66) CYP1A2CYP2D6CYP2C19RAB9APTGS1
SCHEMBL29996855 0.76 CYP1A2 (0.66) CYP1A2CYP2D6CYP2C19RAB9APTGS1
SCHEMBL14972697 0.75 CYP1A2 (0.64) CYP1A2CYP2D6CYP2C19RAB9APTGS1
SCHEMBL6815102 0.73 AR (0.42) HDAC1HDAC8HDAC6HDAC2HDAC3
SCHEMBL11337669 0.73 AR (0.43)
SCHEMBL26416635 0.73 MAPT (0.62) RAB9APTGS1HDAC8HDAC6MAPT
SCHEMBL28437543 0.72 HDAC1 (0.56) RAB9APTGS1HDAC1HDAC8HDAC6
SCHEMBL30319935 0.71 PTGS1 (0.64) CYP1A2CYP2D6CYP2C19RAB9APTGS1

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
CN-115216004-A Polyimide resin, polyimide film, flexible device, and electronic apparatus 华为技术有限公司 2022-10-21 CN disclosed