SCHEMBL3840160

SCHEMBL3840160

Cc1cnc(/N=N/c2ccc3cc(S(=O)(=O)O)ccc3c2O)s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 3/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ CYP1A2 P05177 5/20 0.45
▸ CYP2C9 P11712 3/20 0.45
▸ HSD17B10 Q99714 3/20 0.42
▸ ALOX15 P16050 2/20 0.42
▸ PTPRC P08575 1/20 0.42
▸ PTPN1 P18031 1/20 0.42
▸ PTPN6 P29350 1/20 0.42
▸ PTPN7 P35236 1/20 0.42
▸ PTPN11 Q06124 1/20 0.42
▸ PTPRJ Q12913 1/20 0.42
▸ DUSP26 Q9BV47 1/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ CTRB1 P17538 1/20 0.41
▸ CYP2C19 P33261 3/20 0.41
▸ TSHR P16473 2/20 0.41

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
SCHEMBL3840161 1.00 HIF1A (0.46) HIF1AALDH1A1CYP1A2CYP2C9HSD17B10
SCHEMBL3841782 0.80 L3MBTL1 (0.48) HIF1AALDH1A1CYP1A2CYP2C9HSD17B10
SCHEMBL3840583 0.80 L3MBTL1 (0.48) HIF1AALDH1A1CYP1A2CYP2C9HSD17B10
SCHEMBL3833682 0.77 APP (0.51) HIF1AALDH1A1CYP1A2HSD17B10ALOX15
SCHEMBL3833685 0.77 APP (0.51) HIF1AALDH1A1CYP1A2HSD17B10ALOX15
SCHEMBL17816075 0.68 AMY1A (0.57) CYP1A2CYP2C9THRBENPP2CD40
SCHEMBL18218127 0.68 CTRB1 (0.53) HIF1AALDH1A1CYP1A2CYP2C9HSD17B10
SCHEMBL17088271 0.67 CYP1A2 (0.52) HIF1AALDH1A1CYP1A2CYP2C9HSD17B10
SCHEMBL13646702 0.67 L3MBTL1 (0.33) ALDH1A1TDP1MEN1THRBKMT2A
SCHEMBL751982 0.67 CYP1A2 (0.70) HIF1AALDH1A1CYP1A2CYP2C9HSD17B10

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
WO-2009124872-A2 ANIONIC DYES AND HAIR DYE COMPOSITIONS CONTAINING THEM DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2009-10-15 — — WO disclosed
EP-2108406-A1 Anionic dyes and hair dye compositions containing them DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2009-10-14 — — EP disclosed
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