SCHEMBL14259356

SCHEMBL14259356

O=S(=O)(O)c1cc(O)c2c(O)c(N=Nc3cc(O)c(N=Nc4cc(SOOO)ccc4O)cc3O)c(SOOO)cc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 2/20 0.47
▸ CYP1A2 P05177 4/20 0.45
▸ CYP2C9 P11712 4/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ DNASE1L3 Q13609 1/20 0.44
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ POLB P06746 1/20 0.41
▸ GRK2 P25098 1/20 0.41
▸ PLEC Q15149 1/20 0.41
▸ PTPN11 Q06124 1/20 0.38
▸ ENPP2 Q13822 4/20 0.35
▸ HTT P42858 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ CYP2C19 P33261 2/20 0.34
▸ HIF1A Q16665 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ TSHR P16473 1/20 0.34
▸ PTPRA P18433 1/20 0.34
▸ PTPRB P23467 1/20 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
SCHEMBL14259343 0.89 CYP1A2 (0.40) PRMT1CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL14443421 0.88 MEN1 (0.56) PRMT1CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL14602384 0.88 MEN1 (0.56) PRMT1CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL14259378 0.87 ENPP2 (0.36) PRMT1CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL14259388 0.79 CYP1A2 (0.55) PRMT1CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL14259341 0.79 PTPN11 (0.42) CYP1A2CYP2C9MAPK1DNASE1L3MEN1
SCHEMBL14500847 0.78 CYP1A2 (0.48) PRMT1CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL14001730 0.77 PTPN11 (0.43) PRMT1CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL14355360 0.77 ENPP2 (0.39) PRMT1CYP1A2CYP2C9MAPK1DNASE1L3
SCHEMBL14602382 0.77 ENPP2 (0.44) PRMT1CYP1A2CYP2C9MAPK1DNASE1L3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080063800-A1 Transition metal complex in liquid medium of water, organic solvent; substituted phenylene or naphthylene; carboxy, sulpho, phosphate water solubilising groups; text, picture, photorealistic; paper, plastic, textile, metal, glass; neutral black shades; storage stability; low tendency to block fine nozzle FUJIFILM IMAGING COLORANTS LIMITED (GB) 2008-03-13 — — US disclosed
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