SCHEMBL26416461

SCHEMBL26416461

Cc1cc(N)ccc1NC(=O)c1ccc(C(=O)Nc2ccc(N)cc2C(F)(F)F)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.66
CYP1A2 P05177 2/20 0.66
CYP2C19 P33261 2/20 0.66
CYP2C9 P11712 1/20 0.66
RAB9A P51151 3/20 0.57
CYP2D6 P10635 1/20 0.57
GAA P10253 2/20 0.49
MAPK1 P28482 1/20 0.49
PTGS1 P23219 4/20 0.47
L3MBTL1 Q9Y468 1/20 0.44
NR1H4 Q96RI1 1/20 0.44
HDAC1 Q13547 2/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
TP53 P04637 1/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 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
SCHEMBL26416602 0.92 CYP1A2 (0.66) MAPTCYP1A2CYP2C19CYP2C9RAB9A
SCHEMBL29996855 0.92 CYP1A2 (0.66) MAPTCYP1A2CYP2C19CYP2C9RAB9A
SCHEMBL14972697 0.90 CYP1A2 (0.64) MAPTCYP1A2CYP2C19CYP2C9RAB9A
SCHEMBL15693306 0.87 MAPT (0.84) MAPTCYP1A2CYP2C19CYP2C9RAB9A
SCHEMBL26416457 0.87 CYP1A2 (0.52) MAPTCYP1A2CYP2C19CYP2C9RAB9A
SCHEMBL30319935 0.86 PTGS1 (0.64) MAPTCYP1A2CYP2C19RAB9ACYP2D6
SCHEMBL28255136 0.86 CYP1A2 (0.59) MAPTCYP1A2CYP2C19CYP2C9RAB9A
SCHEMBL3880896 0.85 MAPT (0.82) MAPTCYP1A2CYP2C19CYP2C9RAB9A
SCHEMBL3528827 0.85 MAPT (0.62) MAPTCYP1A2CYP2C19CYP2C9RAB9A
SCHEMBL7301522 0.82 MAPT (0.71) MAPTCYP1A2CYP2C19CYP2C9RAB9A

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
US-20230125363-A1 Polyamideimide Precursor, Polyamideimide Prepared Therefrom, and Polyamideimide Film Including the Same SK IE TECHNOLOGY CO., LTD. (KR) 2023-04-27 US disclosed