SCHEMBL27770231

SCHEMBL27770231

O=S(=O)(O)c1cc2ccccc2c(S(=O)(=O)O)c1N=Nc1cccc2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 6/20 0.62
▸ CYP2C9 P11712 2/20 0.62
▸ MAPK1 P28482 2/20 0.62
▸ DNASE1L3 Q13609 1/20 0.62
▸ HIF1A Q16665 3/20 0.61
▸ ALDH1A1 P00352 2/20 0.61
▸ TSHR P16473 1/20 0.57
▸ PTPRA P18433 1/20 0.57
▸ PTPRB P23467 1/20 0.57
▸ CYP2C19 P33261 1/20 0.57
▸ RAPGEF4 Q8WZA2 1/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ HPGD P15428 1/20 0.53
▸ PRMT1 Q99873 1/20 0.53
▸ PTPN11 Q06124 1/20 0.52
▸ SENP2 Q9HC62 1/20 0.52
▸ SENP1 Q9P0U3 1/20 0.52
▸ MPL P40238 4/20 0.50
▸ CTRC Q99895 2/20 0.50
▸ CTRB1 P17538 1/20 0.49

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
SCHEMBL29894000 0.86 CYP1A2 (0.72) CYP1A2CYP2C9MAPK1DNASE1L3HIF1A
SCHEMBL14400947 0.86 CYP1A2 (0.72) CYP1A2CYP2C9MAPK1DNASE1L3HIF1A
SCHEMBL1866549 0.84 CYP1A2 (0.54) CYP1A2CYP2C9MAPK1DNASE1L3HIF1A
SCHEMBL1866548 0.84 CYP1A2 (0.54) CYP1A2CYP2C9MAPK1DNASE1L3HIF1A
SCHEMBL16689771 0.83 CYP1A2 (0.84) CYP1A2CYP2C9MAPK1DNASE1L3HIF1A
SCHEMBL5489756 0.81 CYP1A2 (0.64) CYP1A2CYP2C9MAPK1DNASE1L3HIF1A
SCHEMBL15181277 0.81 CYP1A2 (0.79) CYP1A2CYP2C9MAPK1DNASE1L3HIF1A
SCHEMBL2015717 0.81 CYP1A2 (0.55) CYP1A2CYP2C9MAPK1DNASE1L3HIF1A
SCHEMBL11883462 0.81 CYP1A2 (0.58) CYP1A2CYP2C9MAPK1DNASE1L3HIF1A
SCHEMBL11883468 0.80 CYP1A2 (0.64) CYP1A2CYP2C9MAPK1DNASE1L3HIF1A

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
CN-101490531-A Method for automatically identifying control liquid ARKRAY INC (JP) 2009-07-22 — — CN claimed
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