SCHEMBL9522846

SCHEMBL9522846

Cc1ccc(C(=O)O)c(S(=O)(=O)Cl)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 2/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
ALOX15 P16050 1/20 0.41
HAAO P46952 1/20 0.38
CYP1A2 P05177 2/20 0.37
LMNA P02545 2/20 0.37
AKR1B10 O60218 1/20 0.37
TRPA1 O75762 1/20 0.37
ABCB11 O95342 1/20 0.37
DHFR P00374 1/20 0.37
MPO P05164 1/20 0.37
CYP3A4 P08684 1/20 0.37
CHRM1 P11229 1/20 0.37
CYP2C9 P11712 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
SCHEMBL893883 0.83 ALDH1A1 (0.43) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL1500751 0.78 ALDH1A1 (0.53) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL4091751 0.78 TDP2 (0.39) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL19039679 0.75 KDM4E (0.43) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL7318386 0.75 ALDH1A1 (0.41) ALDH1A1ALOX15CYP1A2LMNACYP3A4
SCHEMBL11373594 0.74 ALOX15 (0.57) ALDH1A1KDM4EHPGDHSD17B10ALOX15
SCHEMBL29370019 0.73 CYP1A2 (0.48) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL242262 0.73 CYP1A2 (0.48) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL28033212 0.73 CYP1A2 (0.48) ALDH1A1MEN1KMT2AKDM4EHPGD
SCHEMBL22636753 0.73 MAPT (0.46) ALDH1A1MEN1KMT2AKDM4EHPGD

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
EP-0336587-B1 FLUOROALKOXY AMINO TRIAZINES FOR CONTROL OF WEEDS IN SUGAR BEETS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-08-11 EP disclosed
EP-0336587-A1 Fluoroalkoxy amino triazines for control of weeds in sugar beets E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-10-11 EP disclosed