SCHEMBL30908293

SCHEMBL30908293

[2H]C([2H])(O)c1ccc2ccc(Cl)nc2c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 8/20 0.36
NOS3 P29474 3/20 0.36
KDM4E B2RXH2 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
HIF1A Q16665 1/20 0.34
RECQL P46063 1/20 0.32
NOS2 P35228 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL13349521 0.85 RECQL (0.47) NOS1NOS3KDM4ECYP3A4CYP2C19
SCHEMBL12891556 0.77 CYP1A2 (0.45) NOS1NOS3KDM4ECYP3A4CYP2C19
SCHEMBL30908359 0.77 NOS1 (0.48) NOS1NOS3NOS2
SCHEMBL1599287 0.77 NOS1 (0.38) NOS1NOS3KDM4ECYP3A4CYP2C19
SCHEMBL27956204 0.75 CA2 (0.50) KDM4EHIF1AALDH1A1HSD17B10
SCHEMBL21458200 0.72 RECQL (0.46) KDM4ECYP3A4CYP2C19HIF1ARECQL
SCHEMBL30718745 0.72 RECQL (0.46) KDM4ECYP3A4CYP2C19HIF1ARECQL
SCHEMBL22933038 0.71 NOS1 (0.49) NOS1NOS3NOS2
SCHEMBL18572376 0.70 CCR9 (0.34) NOS1NOS3KDM4ECYP3A4CYP2C19
SCHEMBL622672 0.70 ALDH1A1 (0.50) KDM4EALDH1A1HSD17B10

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
WO-2024074611-A1 PRMT5 INHIBITORS Ryvu Therapeutics S.A. (PL) 2024-04-11 WO disclosed