SCHEMBL8697325

SCHEMBL8697325

CNc1ccc(Nc2ccc(C)c(S(=O)(=O)F)c2)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY12 Q9H244 9/20 0.50
▸ MET P08581 2/20 0.47
▸ GNG2 P59768 2/20 0.47
▸ GNB1 P62873 2/20 0.47
▸ P2RY4 P51582 9/20 0.46
▸ P2RY2 P41231 5/20 0.45
▸ P2RY6 Q15077 3/20 0.45
▸ P2RY1 P47900 2/20 0.45
▸ EGFR P00533 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ PABPC1 P11940 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ ADORA1 P30542 1/20 0.41
▸ HGF P14210 1/20 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
SCHEMBL7743710 0.83 P2RY12 (0.53) P2RY12METGNG2GNB1P2RY4
SCHEMBL344330 0.83 GNG2 (0.56) P2RY12METGNG2GNB1P2RY4
SCHEMBL20520387 0.80 MAPT (0.54) P2RY12METGNG2GNB1P2RY4
SCHEMBL10808332 0.79 MET (0.49) P2RY12METGNG2GNB1P2RY4
SCHEMBL92477 0.78 P2RY2 (0.55) P2RY12GNG2GNB1P2RY4P2RY2
SCHEMBL29377518 0.78 P2RY2 (0.55) P2RY12GNG2GNB1P2RY4P2RY2
SCHEMBL30513727 0.78 P2RY2 (0.55) P2RY12GNG2GNB1P2RY4P2RY2
SCHEMBL717132 0.78 P2RY4 (0.58) P2RY12GNG2GNB1P2RY4P2RY2
SCHEMBL29448193 0.78 P2RY4 (0.58) P2RY12GNG2GNB1P2RY4P2RY2
SCHEMBL30508524 0.78 P2RY4 (0.58) P2RY12GNG2GNB1P2RY4P2RY2

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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