SCHEMBL7712957

SCHEMBL7712957

O=C(O)c1ccc(S(=O)(=O)O)cc1Nc1n[c]nc(F)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
DUSP26 Q9BV47 1/20 0.36
CASR P41180 1/20 0.34
SNCA P37840 2/20 0.34
CDC7 O00311 2/20 0.34
DAPK3 O43293 2/20 0.34
PIM1 P11309 2/20 0.34
CDK2 P24941 2/20 0.34
FLT3 P36888 2/20 0.34
GSK3B P49841 2/20 0.34
CDK9 P50750 2/20 0.34
CDK5 Q00535 2/20 0.34
DYRK1A Q13627 2/20 0.34
MELK Q14680 2/20 0.34

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
SCHEMBL7712964 0.91 KDM4E (0.42) ALDH1A1HSD17B10KDM4EHPGDMEN1
SCHEMBL4650779 0.84 SNCA (0.35) ALDH1A1HSD17B10CASRSNCACA1
SCHEMBL8040793 0.83 ALDH1A1 (0.35) ALDH1A1MEN1KMT2ACASRSNCA
SCHEMBL7718114 0.83 SNCA (0.40) ALDH1A1KDM4ESNCACA1CA2
SCHEMBL7720114 0.82 CASP6 (0.39) ALDH1A1HSD17B10MEN1KMT2ARXFP1
SCHEMBL7717587 0.81 TIMP3 (0.39) ALDH1A1HSD17B10KDM4EMEN1KMT2A
SCHEMBL7718715 0.81 LRRK2 (0.40) SNCACA1CA2
SCHEMBL7716378 0.81 SNCA (0.40) ALDH1A1KDM4ESNCACDK2CA1
SCHEMBL6547466 0.78 CDC7 (0.52) ALDH1A1KDM4EHPGDCDC7DAPK3
SCHEMBL7712992 0.78 LRRK2 (0.42) ALDH1A1HSD17B10KDM4EKMT2ACASR

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5808015-A RED FIBER REACTIVE, ACID DYES FOR CELLULOSE FIBERS, COTTON, WOOL, SILK, POLYAMIDES, POLYESTERS, POLYOLEFINS AND POLYACRYLONITRILE; COLORFASTNESS; BRIGHTNESS; TRIAZINE DYES BAYER AKTIENGESELLSCHAFT (DE) 1998-09-15 US claimed
US-5744589-A FOR DYEING OR PRINTING SUBSTRATES BAYER AKTIENGESELLSCHAFT (DE) 1998-04-28 US claimed
US-6376656-B1 DISAZO DYES, TRIAZINE DYES DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2002-04-23 US disclosed
US-6136970-A COLORFAST FIBER-REACTIVE DYES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-10-24 US disclosed
US-6025478-A HIGH REACTIVITY AND FIXING CAPACITY, GOOD LOW TEMPERATURE DYEING, GOOD COLOR INTENSITY, LIGHTFASTNESS, WASHFASTNESS BAYER AG (DE) 2000-02-15 US disclosed
US-5955615-A COUPLERS BAYER AKTIENGESELLSCHAFT (DE) 1999-09-21 US disclosed
US-5808015-A RED FIBER REACTIVE, ACID DYES FOR CELLULOSE FIBERS, COTTON, WOOL, SILK, POLYAMIDES, POLYESTERS, POLYOLEFINS AND POLYACRYLONITRILE; COLORFASTNESS; BRIGHTNESS; TRIAZINE DYES BAYER AKTIENGESELLSCHAFT (DE) 1998-09-15 US disclosed
US-5760193-A FOR COTTON, WOOL, POLYAMIDES; HIGH COLOR STRENGTH, COLORFASTNESS DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 1998-06-02 US disclosed
EP-0472975-B1 Asymmetric dioxazine compounds and method for dyeing or printing fiber materials using the same SUMITOMO CHEMICAL CO (JP) 1997-12-17 EP disclosed
US-5625042-A DYEING OR PRINTING MATERIAL HYDROXY OR AMIDE GROUPS BY APPLYING DYES WITH DISAZO AND TRIAZINE GROUPS BAYER AKTIENGESELLSCHAFT (DE) 1997-04-29 US disclosed
EP-0541084-B1 Asymmetric dioxazine compounds and method for dyeing or printing fiber materials using the same SUMITOMO CHEMICAL CO (JP) 1997-02-26 EP disclosed
US-5266696-A Colorfast dyes, dyeing, printing and dyed fibers SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-11-30 US disclosed
EP-0541084-A2 Asymmetric dioxazine compounds and method for dyeing or printing fiber materials using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-05-12 EP disclosed
US-5112971-A ANTHRAQUINONE DYE COMPOUNDS HAVING FIBERS REACTIVE GROUP SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-05-12 US disclosed
US-5095102-A 6-SUBSTITUTED SULPHONYL-8-SULPHO-2-NAPHTHYL MONOAZO REACTIVE DYESTUFFS BAYER AKTIENGESELLSCHAFT (DE) 1992-03-10 US disclosed
EP-0472975-A2 Asymmetric dioxazine compounds and method for dyeing or printing fiber materials using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-03-04 EP disclosed
US-5057609-A TRIPHENDIOXAZINE DYESTUFFS BAYER AKTIENGESELLSCHAFT (DE) 1991-10-15 US disclosed
US-4874857-A FIBER-REACTIVE DYES BAYER AKTIENGESELLSCHAFT (DE) 1989-10-17 US disclosed
US-4806640-A Triphendioxazine reactive dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1989-02-21 US disclosed
US-4777247-A Heavy metal-containing monoazo dyes BAYER AKTIENGESELLSCHAFT (DE) 1988-10-11 US disclosed