SCHEMBL20428404

SCHEMBL20428404

COc1ccc(N(C)c2cc(=O)oc3ccccc23)cc1OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 3/20 0.49
HPGD P15428 3/20 0.49
KDM4E B2RXH2 3/20 0.49
CYP3A4 P08684 2/20 0.49
MAPT P10636 2/20 0.49
HSD17B10 Q99714 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
GLA P06280 1/20 0.49
ABCB1 P08183 1/20 0.49
THRB P10828 1/20 0.49
MAPK1 P28482 1/20 0.49
NPC1 O15118 2/20 0.49
ABCG2 Q9UNQ0 1/20 0.48
MAOA P21397 5/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
LMNA P02545 1/20 0.46
TP53 P04637 1/20 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
SCHEMBL20420749 0.91 L3MBTL1 (0.47) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL20428400 0.91 ALDH1A1 (0.41) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL20428340 0.90 ALDH1A1 (0.40) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL20420735 0.90 ALDH1A1 (0.43) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL20420770 0.90 ALDH1A1 (0.40) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL31005008 0.89 NQO1 (0.49) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL20420753 0.89 CA12 (0.48) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL20420720 0.89 NQO1 (0.49) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL20428284 0.88 ACHE (0.45) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL20420797 0.88 ALDH1A1 (0.42) MEN1KMT2AALDH1A1HPGDKDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108349959-B 4-substituted coumarin derivative and preparation method and application thereof 成都赜灵生物医药科技有限公司 2021-11-16 CN disclosed
EP-3354648-A1 4-SUBSTITUED COUMARIN DERIVATIVE, AND PREPARATION METHOD AND USE THEREOF Guizhou Bailing Group Pharmaceutical Co., Ltd. (CN) 2018-08-01 EP disclosed
CN-108349959-A The coumarin derivative and its preparation method and application of 4 substitutions 贵州百灵企业集团制药股份有限公司 2018-07-31 CN disclosed