SCHEMBL8064223

SCHEMBL8064223

Cc1cc(=O)[nH]c2cc([NH])ccc12

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.62
GAA P10253 4/20 0.62
GLA P06280 3/20 0.62
ALDH1A1 P00352 3/20 0.62
HPGD P15428 3/20 0.62
TP53 P04637 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
TNKS2 Q9H2K2 9/20 0.58
CYP1A2 P05177 2/20 0.58
CYP2C19 P33261 1/20 0.58
TNKS O95271 1/20 0.50
LMNA P02545 1/20 0.49
HSD17B10 Q99714 2/20 0.46
MAPT P10636 2/20 0.46
TSHR P16473 1/20 0.46
CYP19A1 P11511 1/20 0.42
NQO2 P16083 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42

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
SCHEMBL8049060 0.80 AR (0.44) KDM4EGAAGLAALDH1A1HPGD
SCHEMBL2795205 0.80 KDM4E (0.67) KDM4EGAAGLAALDH1A1HPGD
SCHEMBL141348 0.77 TNKS2 (0.66) KDM4EGAAGLAALDH1A1HPGD
SCHEMBL2798886 0.77 KDM4E (0.62) KDM4EGAAGLAALDH1A1HPGD
SCHEMBL29892996 0.77 KDM4E (0.62) KDM4EGAAGLAALDH1A1HPGD
SCHEMBL592109 0.77 KDM4E (1.00) KDM4EGAAGLAALDH1A1HPGD
SCHEMBL1378769 0.77 TNKS2 (0.75) KDM4EGAAGLAALDH1A1HPGD
SCHEMBL13264599 0.77 KDM4E (0.62) KDM4EGAAGLAALDH1A1HPGD
SCHEMBL29532206 0.77 KDM4E (1.00) KDM4EGAAGLAALDH1A1HPGD
SCHEMBL29400852 0.77 TNKS2 (0.66) KDM4EGAAGLAALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0838504-B1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof DYSTAR TEXTILFARBEN GMBH & CO (DE) 2000-06-07 EP disclosed
US-5834601-A DYEING CELLULOSE, WOOL, POLYAMIDE DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 1998-11-10 US disclosed
EP-0838504-A1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1998-04-29 EP disclosed