SCHEMBL23624675

SCHEMBL23624675

COC1C(O)[C@@H](COP(=S)(OCCC#N)OC2C(F)[C@H](n3cnc4c(NC(=O)c5ccccc5)ncnc43)O[C@@H]2CO)O[C@H]1n1cnc2c(NC(=O)c3ccccc3)ncnc21

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ P2RY12 Q9H244 3/20 0.47
▸ DNPH1 O43598 3/20 0.45
▸ P2RY2 P41231 1/20 0.44
▸ P2RY1 P47900 1/20 0.44
▸ P2RY6 Q15077 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ ADORA3 P0DMS8 1/20 0.44
▸ ADORA1 P30542 3/20 0.43
▸ GAPDH P04406 1/20 0.42
▸ P2RX3 P56373 1/20 0.41
▸ P2RX4 Q99571 1/20 0.41
▸ P2RX2 Q9UBL9 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
SCHEMBL23624816 0.95 P2RY12 (0.49) P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL19250015 0.90 P2RY12 (0.41) P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL23624673 0.90 TYMP (0.46) P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL23625051 0.89 RNASEL (0.45) P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL21274766 0.88 RNASEL (0.46) P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL21307917 0.88 RNASEL (0.46) P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL17860555 0.88 P2RY12 (0.42) P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL17860595 0.86 P2RY12 (0.42) P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL18917301 0.85 P2RY12 (0.39) P2RY12DNPH1P2RY2P2RY1P2RY6
SCHEMBL18927171 0.85 P2RY12 (0.39) P2RY12DNPH1P2RY2P2RY1P2RY6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11597932-B2 Chirally-enriched double-stranded RNA agents ALNYLAM PHARMACEUTICALS, INC. (US) 2023-03-07 — — US disclosed
US-20210207144-A1 CHIRALLY-ENRICHED DOUBLE-STRANDED RNA AGENTS BANK OF AMERICA, N.A. 2021-07-08 — — US disclosed
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