SCHEMBL9155286

SCHEMBL9155286

C[SiH](C)[C@]1(n2cnc3c(NC(=O)c4ccccc4)ncnc32)C[C@H](OC(C)(C)C)[C@@H](CN)O1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 1/20 0.39
P2RY12 Q9H244 4/20 0.35
ADORA1 P30542 2/20 0.33
ADORA3 P0DMS8 1/20 0.33
ADORA2A P29274 1/20 0.33
BMPR1B O00238 1/20 0.32
P2RY2 P41231 1/20 0.32
P2RY1 P47900 1/20 0.32
P2RY6 Q15077 1/20 0.32

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
SCHEMBL9227355 0.77 PI4KA (0.37) ADORA1ADORA3ADORA2AP2RY1
SCHEMBL6402247 0.76 ADORA1 (0.39) P2RY12ADORA1ADORA3ADORA2A
SCHEMBL8923627 0.76 PRMT6 (0.36) PRMT6P2RY12ADORA1BMPR1BP2RY2
SCHEMBL2290374 0.72 TRPM2 (0.56)
SCHEMBL8332514 0.72 PRMT6 (0.33) PRMT6P2RY12ADORA1ADORA3ADORA2A
SCHEMBL7863923 0.71 PRMT6 (0.35) PRMT6P2RY12ADORA1ADORA3ADORA2A
SCHEMBL8958836 0.70 PRMT6 (0.34) PRMT6ADORA1ADORA3ADORA2A
SCHEMBL9155260 0.70 PRMT6 (0.45) PRMT6P2RY12ADORA1P2RY1
SCHEMBL9155270 0.70 PRMT6 (0.45) PRMT6P2RY12ADORA1P2RY1
SCHEMBL8937135 0.70 ADORA1 (0.34) PRMT6P2RY12ADORA1ADORA3ADORA2A

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-5470967-A Hybridization probes to detect nucleic acid sequences THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) 1995-11-28 US disclosed
EP-0517796-B1 OLIGONUCLEOTIDE ANALOGS DU PONT MERCK PHARMA (US) 1995-04-19 EP disclosed