SCHEMBL8696234

SCHEMBL8696234

Nc1ccc(Nc2ccc(S(=O)(=O)F)cc2)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY12 Q9H244 9/20 0.52
▸ FGR P09769 1/20 0.51
▸ PIM1 P11309 1/20 0.51
▸ MAOA P21397 1/20 0.51
▸ ADORA2A P29274 1/20 0.51
▸ CSNK1A1 P48729 1/20 0.51
▸ CSNK1D P48730 1/20 0.51
▸ DYRK1A Q13627 1/20 0.51
▸ HIPK2 Q9H2X6 1/20 0.51
▸ CSNK1G1 Q9HCP0 1/20 0.51
▸ P2RY4 P51582 9/20 0.49
▸ MET P08581 2/20 0.49
▸ HGF P14210 2/20 0.49
▸ P2RY2 P41231 7/20 0.48
▸ LMNA P02545 1/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ HIF1A Q16665 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48

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
SCHEMBL4704714 0.84 ADORA2A (0.59) P2RY12FGRPIM1MAOAADORA2A
SCHEMBL169365 0.84 ADORA2A (0.63) P2RY12FGRPIM1MAOAADORA2A
SCHEMBL29527792 0.84 ADORA2A (0.63) P2RY12FGRPIM1MAOAADORA2A
SCHEMBL30918998 0.84 ADORA2A (0.63) P2RY12FGRPIM1MAOAADORA2A
SCHEMBL1994395 0.82 P2RY12 (0.60) P2RY12FGRPIM1MAOAADORA2A
SCHEMBL10809232 0.82 P2RY4 (0.60) P2RY12FGRPIM1MAOAADORA2A
SCHEMBL11121784 0.81 MEN1 (0.55) P2RY12FGRPIM1MAOAADORA2A
SCHEMBL7037057 0.81 ADORA2A (0.73) P2RY12FGRPIM1MAOAADORA2A
SCHEMBL13717469 0.81 P2RY12 (0.57) P2RY12FGRPIM1MAOAADORA2A
SCHEMBL8698317 0.81 P2RY12 (0.70) P2RY12P2RY4METHGFP2RY2

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-5759211-A COLORING SYNTHETIC TEXTILE OR FIBER BLEND ZENECA LIMITED (GB) 1998-06-02 — — US disclosed
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