SCHEMBL7736367

SCHEMBL7736367

NC(=O)c1cccc(C(=O)O)c1S(=O)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.50
ALDH1A1 P00352 5/20 0.43
CYP2D6 P10635 1/20 0.42
F2 P00734 2/20 0.42
PRSS1 P07477 2/20 0.42
PRSS2 P07478 2/20 0.42
PRSS3 P35030 2/20 0.42
MMP2 P08253 2/20 0.41
G6PD P11413 1/20 0.41
CASP7 P55210 1/20 0.41
CASP6 P55212 1/20 0.41
BCAT2 O15382 1/20 0.41
TSHR P16473 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
NR4A1 P22736 1/20 0.38

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
SCHEMBL30723106 0.90 ALDH1A1 (0.45) ALOX15ALDH1A1BCAT2TSHRKDM4E
Benzene SCHEMBL10638262 0.90 ALOX15 (0.59) ALOX15ALDH1A1CYP2D6MMP2G6PD
SCHEMBL65889 0.90 ALOX15 (0.59) ALOX15ALDH1A1CYP2D6MMP2G6PD
SCHEMBL143947 0.88 ALOX15 (0.57) ALOX15ALDH1A1CYP2D6MMP2G6PD
SCHEMBL3781304 0.88 ALOX15 (0.57) ALOX15ALDH1A1CYP2D6MMP2G6PD
Ammonia Solution, Strong SCHEMBL3299235 0.88 ALOX15 (0.57) ALOX15ALDH1A1CYP2D6MMP2G6PD
Phosphine SCHEMBL3820807 0.88 ALOX15 (0.57) ALOX15ALDH1A1CYP2D6MMP2G6PD
Phosphine SCHEMBL3135561 0.88 ALOX15 (0.57) ALOX15ALDH1A1CYP2D6MMP2G6PD
SCHEMBL20471934 0.88 ALOX15 (0.57) ALOX15ALDH1A1CYP2D6MMP2G6PD
SCHEMBL812165 0.88 ALOX15 (0.57) ALOX15ALDH1A1CYP2D6MMP2G6PD

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
EP-0728801-B1 Laminated film TEIJIN LTD (JP) 2002-05-02 EP disclosed
US-5958552-A Laminated film TEIJIN LIMITED (JP) 1999-09-28 US disclosed
EP-0728801-A2 Laminated film TEIJIN LIMITED (JP) 1996-08-28 EP disclosed