SCHEMBL23948487

SCHEMBL23948487

CCOC(=O)c1cnc(SC)nc1NC1CC(C(N)=O)C1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.57
SYK P43405 3/20 0.55
MAPT P10636 6/20 0.53
LMNA P02545 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
FOS P01100 1/20 0.53
JUN P05412 1/20 0.53
NFKB1 P19838 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
MAPK1 P28482 3/20 0.52
HTT P42858 1/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
TDP1 Q9NUW8 2/20 0.47
POLB P06746 1/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 2/20 0.46
NR2F2 P24468 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46

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
SCHEMBL29502019 1.00 ALDH1A1 (0.57) ALDH1A1SYKMAPTLMNASMN1; SMN2
SCHEMBL29502087 1.00 ALDH1A1 (0.57) ALDH1A1SYKMAPTLMNASMN1; SMN2
SCHEMBL26159724 1.00 ALDH1A1 (0.57) ALDH1A1SYKMAPTLMNASMN1; SMN2
SCHEMBL25239213 1.00 ALDH1A1 (0.57) ALDH1A1SYKMAPTLMNASMN1; SMN2
SCHEMBL30241860 0.90 ALDH1A1 (0.58) ALDH1A1SYKMAPTLMNASMN1; SMN2
SCHEMBL29502038 0.90 ALDH1A1 (0.58) ALDH1A1SYKMAPTLMNASMN1; SMN2
SCHEMBL26159752 0.90 ALDH1A1 (0.58) ALDH1A1SYKMAPTLMNASMN1; SMN2
SCHEMBL23948489 0.90 ALDH1A1 (0.58) ALDH1A1SYKMAPTLMNASMN1; SMN2
SCHEMBL29502008 0.90 ALDH1A1 (0.58) ALDH1A1SYKMAPTLMNASMN1; SMN2
SCHEMBL26159725 0.90 ALDH1A1 (0.58) ALDH1A1SYKMAPTLMNASMN1; SMN2

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