SCHEMBL7507931

SCHEMBL7507931

CCc1nc2c(s1)C=Cc1cc(C)ccc1C2c1c[nH]c(=O)[nH]c1=S

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ P2RY2 P41231 12/20 0.47
▸ MAPT P10636 1/20 0.30
▸ RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL7507329 0.90 P2RY2 (0.41) P2RY2
SCHEMBL7509787 0.81 P2RY2 (0.70) P2RY2
SCHEMBL7505694 0.80 P2RY2 (0.39) P2RY2
SCHEMBL7495877 0.80 P2RY2 (0.46) P2RY2MAPT
SCHEMBL7485651 0.79 P2RY2 (0.47) P2RY2MAPTRXFP1
SCHEMBL7512427 0.73 MAPK14 (0.33) P2RY2
SCHEMBL7504709 0.71 P2RY2 (0.39) P2RY2
SCHEMBL7503428 0.71 P2RY2 (0.86) P2RY2
SCHEMBL7500497 0.71 P2RY2 (0.62) P2RY2
SCHEMBL7505786 0.69 GRM7 (0.35) P2RY2MAPT

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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