SCHEMBL7503428

SCHEMBL7503428

Cc1ccc2c(c1)C=Cc1sc(C)nc1C2c1cn(C)c(=O)[nH]c1=S

nearest known ligand 0.86

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ P2RY2 P41231 20/20 0.86

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
SCHEMBL7504089 0.92 P2RY2 (1.00) P2RY2
SCHEMBL7505761 0.90 P2RY2 (0.70) P2RY2
SCHEMBL7503919 0.87 P2RY2 (0.75) P2RY2
SCHEMBL7501542 0.85 P2RY2 (0.66) P2RY2
SCHEMBL7503368 0.84 P2RY2 (0.62) P2RY2
SCHEMBL7508460 0.83 P2RY2 (0.84) P2RY2
SCHEMBL7501727 0.82 P2RY2 (0.81) P2RY2
SCHEMBL7502865 0.82 P2RY2 (0.80) P2RY2
SCHEMBL7504203 0.82 P2RY2 (0.80) P2RY2
SCHEMBL7506443 0.81 P2RY2 (0.79) P2RY2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1042320-B1 NEW COMPOUNDS WHICH ARE P2-PURINOCEPTOR 7-TRANSMEMBRANE (TM) G-PROTEIN COUPLED RECEPTOR ANTAGONISTS ASTRAZENECA UK LTD (GB) 2002-02-13 — — EP claimed
US-6218376-B1 FOR TREATING INFLAMMATORY DISEASES ASTRAZENECA UK LIMITED (GB) 2001-04-17 — — US claimed
EP-1042320-B1 NEW COMPOUNDS WHICH ARE P2-PURINOCEPTOR 7-TRANSMEMBRANE (TM) G-PROTEIN COUPLED RECEPTOR ANTAGONISTS ASTRAZENECA UK LTD (GB) 2002-02-13 — — EP disclosed
US-6218376-B1 FOR TREATING INFLAMMATORY DISEASES ASTRAZENECA UK LIMITED (GB) 2001-04-17 — — US disclosed
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