SCHEMBL7002381

SCHEMBL7002381

CCCCNc1nc(SC2CCCC2)nc2c1nnn2C1CC(CO)[C@@H](O)C1O

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ P2RY12 Q9H244 19/20 0.77
▸ AHCY P23526 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
SCHEMBL7002377 1.00 P2RY12 (0.77) P2RY12AHCY
SCHEMBL6995464 0.87 P2RY12 (1.00) P2RY12
SCHEMBL6999864 0.87 P2RY12 (1.00) P2RY12
SCHEMBL6995474 0.87 P2RY12 (1.00) P2RY12
SCHEMBL7512903 0.86 P2RY12 (0.78) P2RY12
SCHEMBL7512896 0.86 P2RY12 (0.78) P2RY12
SCHEMBL7475374 0.80 P2RY12 (0.86) P2RY12
SCHEMBL7475367 0.80 P2RY12 (0.86) P2RY12
SCHEMBL7002539 0.80 P2RY12 (0.70) P2RY12AHCY
SCHEMBL7002536 0.80 P2RY12 (0.70) P2RY12AHCY

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-0996621-B1 TRIAZOLO[4,5-d]PYRIMIDINE DERIVATIVES AS ANTI-THROMBOTIC AGENTS ASTRAZENECA AB (SE) 2003-10-01 — — EP claimed
US-6251910-B1 1,2,3-triazolo[4,5-d]pyrimidines as P2T receptor antagonists ASTRAZENECA UK LIMITED (GB) 2001-06-26 — — US claimed
EP-0996621-B1 TRIAZOLO[4,5-d]PYRIMIDINE DERIVATIVES AS ANTI-THROMBOTIC AGENTS ASTRAZENECA AB (SE) 2003-10-01 — — EP disclosed
US-6251910-B1 1,2,3-triazolo[4,5-d]pyrimidines as P2T receptor antagonists ASTRAZENECA UK LIMITED (GB) 2001-06-26 — — US disclosed
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