SCHEMBL23948231

SCHEMBL23948231

CSc1ncc(C(=O)O)c(NC2CC(O)C2)n1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 1/20 0.44
SYK P43405 2/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPK8 P45983 9/20 0.40
MAPK9 P45984 5/20 0.40
PPARG P37231 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ITGB1 P05556 1/20 0.38
ITGA4 P13612 1/20 0.38
PDE4B Q07343 1/20 0.36
THRB P10828 1/20 0.36

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
SCHEMBL26159709 1.00 MERTK (0.44) MERTKSYKMEN1KMT2AMAPK8
SCHEMBL25057374 0.90 SYK (0.41) MERTKSYKMEN1KMT2AMAPK8
SCHEMBL14656638 0.89 MAPK8 (0.54) MERTKSYKMAPK8MAPK9
SCHEMBL26931049 0.88 MERTK (0.57) MERTKSYKMAPK8MAPK9PPARG
SCHEMBL26931042 0.88 MERTK (0.57) MERTKSYKMAPK8MAPK9PPARG
SCHEMBL15249748 0.88 SYK (0.51) MERTKSYKMEN1KMT2APPARG
SCHEMBL26161013 0.85 SYK (0.49) MERTKSYKMEN1KMT2AMAPK8
SCHEMBL1226594 0.85 MEN1 (0.49) MERTKSYKMEN1KMT2AMAPK8
SCHEMBL23948485 0.85 SYK (0.38) MERTKSYKMEN1KMT2APPARG
SCHEMBL26159756 0.85 SYK (0.38) MERTKSYKMEN1KMT2APPARG

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
EP-4137491-A1 IMIDAZOLINONE DERIVATIVE AND USE THEREOF IN MEDICINE Chengdu Baiyu Pharmaceutical Co., Ltd. (CN) 2023-02-22 EP disclosed
WO-2021209055-A1 IMIDAZOLINONE DERIVATIVE AND USE THEREOF IN MEDICINE 成都百裕制药股份有限公司 2021-10-21 WO disclosed