SCHEMBL23601285

SCHEMBL23601285

CC(C)/N=C(\S)N(C)c1nc2nncn2c2cc(Cl)ccc12

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAT2A P31153 8/20 0.36
▸ HRH4 Q9H3N8 2/20 0.34
▸ FNTA P49354 1/20 0.33
▸ FNTB P49356 1/20 0.33
▸ PRMT5 O14744 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ HRH3 Q9Y5N1 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ GAA P10253 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
SCHEMBL23601930 0.79 MAT2A (0.41) MAT2AHRH4FNTAFNTBPRMT5
SCHEMBL23577499 0.73 CSF1R (0.44) MAT2AHRH4PRMT5CYP1A2TP53
SCHEMBL30961036 0.73 CSF1R (0.44) MAT2AHRH4PRMT5CYP1A2TP53
SCHEMBL23601772 0.70 MAT2A (0.45) MAT2AFNTAFNTBPRMT5CYP1A2
SCHEMBL29909232 0.69 HRH4 (0.43) HRH4SMN1; SMN2HRH3TP53
SCHEMBL23577370 0.69 HRH4 (0.43) HRH4SMN1; SMN2HRH3TP53
SCHEMBL23601458 0.69 MAT2A (0.36) MAT2AHRH4FNTAFNTBPRMT5
SCHEMBL23601277 0.69 MAT2A (0.36) MAT2AHRH4FNTAFNTBPRMT5
SCHEMBL23601427 0.69 MAT2A (0.36) MAT2AHRH4FNTAFNTBPRMT5
SCHEMBL23601425 0.69 MAT2A (0.36) MAT2AHRH4FNTAFNTBPRMT5

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-2021130638-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS CARNA BIOSCIENCES, INC. (JP) 2021-07-01 — — WO disclosed
Send feedback