SCHEMBL9054973

SCHEMBL9054973

Nc1ccc(C(=O)Nc2ccc(N)cc2S(=O)(=O)O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.60
ALDH1A1 P00352 3/20 0.55
HSD17B10 Q99714 3/20 0.55
CYP1A2 P05177 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
HPGD P15428 1/20 0.55
ATIC P31939 1/20 0.55
MAPT P10636 5/20 0.54
GAA P10253 3/20 0.54
POLB P06746 3/20 0.54
TDP1 Q9NUW8 3/20 0.54
CASP6 P55212 3/20 0.54
KDM4E B2RXH2 2/20 0.54
RECQL P46063 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
APEX1 P27695 2/20 0.54
NSD2 O96028 1/20 0.54
APOBEC3A P31941 1/20 0.54
APOBEC3G Q9HC16 1/20 0.54
MEN1 O00255 3/20 0.51

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
SCHEMBL9353760 0.91 MAPT (0.62) RAPGEF4ALDH1A1HSD17B10CYP1A2SMN1; SMN2
SCHEMBL10877294 0.90 MEN1 (0.58) RAPGEF4ALDH1A1HSD17B10CYP1A2SMN1; SMN2
SCHEMBL27141426 0.90 TIMP3 (0.65) RAPGEF4ALDH1A1HSD17B10CYP1A2SMN1; SMN2
SCHEMBL29637817 0.87 TIMP3 (0.59) RAPGEF4ALDH1A1HSD17B10CYP1A2SMN1; SMN2
SCHEMBL4898797 0.85 ALDH1A1 (0.47) RAPGEF4ALDH1A1HSD17B10CYP1A2SMN1; SMN2
SCHEMBL16673108 0.83 RAPGEF4 (0.63) RAPGEF4ALDH1A1HSD17B10CYP1A2SMN1; SMN2
SCHEMBL3830815 0.81 RAPGEF4 (0.59) RAPGEF4ALDH1A1HSD17B10CYP1A2SMN1; SMN2
SCHEMBL17491048 0.80 HDAC2 (0.47) RAPGEF4ALDH1A1HSD17B10CYP1A2SMN1; SMN2
SCHEMBL11818286 0.79 RAPGEF4 (0.58) RAPGEF4ALDH1A1HSD17B10CYP1A2SMN1; SMN2
SCHEMBL8986206 0.79 ALDH1A1 (0.59) RAPGEF4ALDH1A1HSD17B10CYP1A2SMN1; SMN2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-61051064-A None JP disclosed
CN-103842329-B Optical directional material 罗利克有限公司 2016-12-07 CN disclosed
CN-104649916-A Photocrosslinkable Materials ROLIC AG 2015-05-27 CN disclosed
CN-103842329-A Photoaligning materials ROLIC AG 2014-06-04 CN disclosed
CN-101687763-B Photocrosslinkable materials comprising alicyclic group ROLIC AG 2014-02-19 CN disclosed
EP-0449250-B1 Trisazo compounds and use thereof SUMITOMO CHEMICAL CO (JP) 1996-11-27 EP disclosed
US-5180817-A Black dyes for cellulose fibers, paper, leather and inks SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-01-19 US disclosed
EP-0449250-A1 Trisazo compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-10-02 EP disclosed
JP-S6151064-A TRISAZO COMPOUND AND METHOD FOR DYEING PAPER PULP BY USING SAME NIPPON KAYAKU CO LTD 1986-03-13 JP disclosed