SCHEMBL23547876

SCHEMBL23547876

CC(C)N(C(C)C)P(OCCC#N)OC[C@H]1O[C@@H](n2cnc3c(NC(=O)c4ccccc4)ncnc32)[C@@H](F)[C@@H]1N

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 1/20 0.43
P2RY12 Q9H244 6/20 0.40
ADORA1 P30542 3/20 0.39
LMNA P02545 1/20 0.39
P2RY2 P41231 1/20 0.39
P2RY1 P47900 1/20 0.39
P2RY6 Q15077 1/20 0.39
BMPR1B O00238 1/20 0.38
DNPH1 O43598 1/20 0.38

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
SCHEMBL23547756 0.92 PRMT6 (0.45) PRMT6P2RY12ADORA1P2RY2P2RY1
SCHEMBL22335434 0.91 PRMT6 (0.44) PRMT6P2RY12ADORA1P2RY2P2RY1
SCHEMBL23547934 0.91 PRMT6 (0.44) PRMT6P2RY12ADORA1P2RY2P2RY1
SCHEMBL29881768 0.89 PRMT6 (0.42) PRMT6P2RY12ADORA1LMNAP2RY2
SCHEMBL18511056 0.89 PRMT6 (0.42) PRMT6P2RY12ADORA1LMNAP2RY2
SCHEMBL20248724 0.89 PRMT6 (0.43) PRMT6P2RY12ADORA1LMNAP2RY2
SCHEMBL26554236 0.89 PRMT6 (0.43) PRMT6P2RY12ADORA1LMNAP2RY2
SCHEMBL25808118 0.89 PRMT6 (0.43) PRMT6P2RY12ADORA1LMNAP2RY2
SCHEMBL18510956 0.89 PRMT6 (0.43) PRMT6P2RY12ADORA1LMNAP2RY2
SCHEMBL18521428 0.88 ADORA1 (0.43) PRMT6P2RY12ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210189392-A1 S-ANTIGEN TRANSPORT INHIBITING OLIGONUCLEOTIDE POLYMERS AND METHODS ALIGOS THERAPEUTICS, INC. 2021-06-24 US disclosed