SCHEMBL8774997

SCHEMBL8774997

Nc1cc(S(=O)(=O)O)cc(NC=O)c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP6 P55212 3/20 0.46
▸ GAA P10253 3/20 0.46
▸ NSD2 O96028 2/20 0.46
▸ PLCG1 P19174 1/20 0.46
▸ DNMT1 P26358 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ NT5E P21589 3/20 0.45
▸ ALDH1A1 P00352 4/20 0.44
▸ HSD17B10 Q99714 3/20 0.44
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ ING2 Q9H160 1/20 0.39
▸ DUSP3 P51452 1/20 0.35
▸ PTPN5 P54829 1/20 0.35
▸ PTPN11 Q06124 1/20 0.35
▸ CASR P41180 1/20 0.35
▸ TSHR P16473 2/20 0.34
▸ CA9 Q16790 3/20 0.34
▸ MAPT P10636 2/20 0.34
▸ CA12 O43570 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
SCHEMBL4649751 0.77 CASP6 (0.62) CASP6GAANSD2PLCG1DNMT1
SCHEMBL343266 0.75 CASR (0.58) CASP6GAANSD2PLCG1DNMT1
SCHEMBL10429504 0.73 CASR (0.56) CASP6GAANSD2PLCG1DNMT1
SCHEMBL10899253 0.71 ALDH1A1 (0.50) CASP6GAANSD2PLCG1DNMT1
SCHEMBL15452138 0.70 RAPGEF4 (0.39) CASP6GAANSD2L3MBTL1NT5E
SCHEMBL9853398 0.70 TIMP3 (0.39) CASP6NT5EALDH1A1HSD17B10CYP2C9
SCHEMBL10727951 0.70 ALDH1A1 (0.47) CASP6GAANSD2PLCG1DNMT1
SCHEMBL10524356 0.70 CISD1 (0.42) CASP6GAANSD2PLCG1DNMT1
SCHEMBL5830318 0.70 CASP6 (0.55) CASP6GAANSD2PLCG1DNMT1
SCHEMBL6935562 0.68 CASP6 (0.53) CASP6GAANSD2PLCG1DNMT1

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
US-5536876-A Formylamino-aminophenol compounds and their use in preparation of fiber-reactive formazan dyes BASF AKTIENGESELLSCHAFT (DE) 1996-07-16 — — US claimed
EP-0574799-B1 Method for the preparation of fibre-reactive formazana dyes as well as aminophenols BASF AG (DE) 1997-09-17 — — EP disclosed
US-5536876-A Formylamino-aminophenol compounds and their use in preparation of fiber-reactive formazan dyes BASF AKTIENGESELLSCHAFT (DE) 1996-07-16 — — US disclosed
US-5488100-A METALLIZED DYES FOR PRINTING AND FIBER REACTIVE DYES FOR CELLULOSE BASF AKTIENGESELLSCHAFT (DE) 1996-01-30 — — US disclosed
US-5488127-A METALLIZED DYES FOR PRINTING AND FIBER REACTIVE DYES FOR CELLULOSE BASF AKTIENGESELLSCHAFT (DE) 1996-01-30 — — US disclosed
US-5446193-A Reacting a benzoxazolone with an amine to form a chemical intermediate for formazan dyes BASF AKTIENGESELLSCHAFT (DE) 1995-08-29 — — US disclosed
US-5410027-A Diazotization of a protectively formylated hydroxyphenylenediamine; coupling with a hydrazone compound; metallization; reacting with a halotriazine BASF AKTIENGESELLSCHAFT (DE) 1995-04-25 — — US disclosed
EP-0592980-A2 Reactive dyes of formazan type containing at least two reactive groups and Aminophenols BASF Aktiengesellschaft (DE) 1994-04-20 — — EP disclosed
EP-0574799-A2 Method for the preparation of fibre-reactive formazana dyes as well as aminophenols BASF Aktiengesellschaft (DE) 1993-12-22 — — EP disclosed
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