SCHEMBL28889168

SCHEMBL28889168

CNC(=S)NC(=O)C(c1cc(C)ccn1)c1ccccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSA P10619 2/20 0.43
MAPT P10636 6/20 0.37
KMT2A Q03164 5/20 0.37
SMN1; SMN2 Q16637 5/20 0.37
MEN1 O00255 4/20 0.37
NPC1 O15118 4/20 0.37
RAB9A P51151 4/20 0.37
HPGD P15428 1/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
MDM2 Q00987 1/20 0.37
ALDH1A1 P00352 6/20 0.36
OPRM1 P35372 2/20 0.36
OPRL1 P41146 2/20 0.36
LMNA P02545 3/20 0.35
HTT P42858 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL28889346 0.89 CTSA (0.42) CTSAMAPTKMT2ASMN1; SMN2MEN1
SCHEMBL28889189 0.89 CTSA (0.45) CTSAMAPTKMT2ASMN1; SMN2MEN1
SCHEMBL28889388 0.86 ALDH1A1 (0.36) CTSAMAPTKMT2ASMN1; SMN2MEN1
SCHEMBL29941823 0.85 ADRB2 (0.40) MAPTKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL28889244 0.84 IDO1 (0.35) CTSAMAPTKMT2AMEN1ALDH1A1
SCHEMBL29893979 0.79 ADRB2 (0.38) MAPTKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL28889227 0.78 CTSA (0.47) CTSAMAPTKMT2ASMN1; SMN2MEN1
SCHEMBL29941794 0.75 ADRB2 (0.38) CTSAMAPTKMT2ASMN1; SMN2MEN1
SCHEMBL28889188 0.75 ADRB2 (0.39) MAPTKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL29941884 0.75 SMARCA2 (0.38) CTSALMNAL3MBTL1

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
WO-2022222911-A1 PYRIMIDONE COMPOUND AND USE THEREOF 武汉人福创新药物研发中心有限公司 2022-10-27 WO disclosed
CN-115215862-A Pyrimidone compounds and uses thereof 武汉人福创新药物研发中心有限公司 2022-10-21 CN disclosed