SCHEMBL11577848

SCHEMBL11577848

N#CC(Cl)Cc1ccccc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 3/20 0.47
TSHR P16473 1/20 0.42
ALDH1A1 P00352 4/20 0.42
ALOX15 P16050 1/20 0.42
TP53 P04637 1/20 0.42
HTT P42858 1/20 0.42
MAPT P10636 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
CYP2C19 P33261 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
HIF1A Q16665 2/20 0.38
GAA P10253 1/20 0.38
KDM4E B2RXH2 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
HMGB1 P09429 1/20 0.37
HPGD P15428 1/20 0.37
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37

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
SCHEMBL11580625 0.87 ALDH1A1 (0.39) FOLH1ALDH1A1ALOX15MAPTCYP2C19
SCHEMBL28029325 0.80 FOLH1 (0.53) FOLH1TSHRALDH1A1ALOX15TP53
SCHEMBL23456400 0.76 FOLH1 (0.49) FOLH1TSHRALDH1A1ALOX15TP53
SCHEMBL9120491 0.74 FOLH1 (0.55) FOLH1TSHRALDH1A1ALOX15TP53
SCHEMBL31612017 0.74 FOLH1 (0.55) FOLH1TSHRALDH1A1ALOX15TP53
SCHEMBL11572942 0.73 FOLH1 (0.47) FOLH1TSHRALDH1A1ALOX15TP53
SCHEMBL11614087 0.73 FOLH1 (0.53) FOLH1TSHRALDH1A1ALOX15TP53
SCHEMBL10409409 0.73 FOLH1 (0.57) FOLH1TSHRALDH1A1ALOX15TP53
SCHEMBL2422410 0.73 FOLH1 (0.53) FOLH1TSHRALDH1A1ALOX15TP53
SCHEMBL8194054 0.73 FOLH1 (0.53) FOLH1TSHRALDH1A1ALOX15TP53

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
US-4105653-A HETERYL-AZO-PHENYL DISPERSE DYESTUFFS CONTAINING A Z-SUBSTITUTED BENZOLYLOXYALKYL RADICAL, WHEREIN Z IS 2-CYANOVINYL 2-CYANOETHYL OR 2-CHLORO-2-CYANOETHYL PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1978-08-08 US disclosed
US-3987027-A DISPERSE AZO DYES PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1976-10-19 US disclosed