SCHEMBL28428097

SCHEMBL28428097

COc1cc(=O)n(C)c2nc(N(C)C)ccc12.Cc1cc(=O)[nH]c2cc(N(C)C)ccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.54
ALDH1A1 P00352 3/20 0.54
HPGD P15428 3/20 0.54
HSD17B10 Q99714 2/20 0.54
GLA P06280 2/20 0.54
GAA P10253 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
TNKS2 Q9H2K2 4/20 0.43
AR P10275 2/20 0.41
ADORA1 P30542 1/20 0.39
NQO2 P16083 4/20 0.37
CYP19A1 P11511 3/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TP53 P04637 1/20 0.36
LCK P06239 1/20 0.35
FGFR1 P11362 1/20 0.35
CDK4 P11802 1/20 0.35
CCNA2 P20248 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
SCHEMBL29377253 0.82 KDM4E (0.56) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL76177 0.82 KDM4E (0.56) KDM4EALDH1A1HPGDHSD17B10GLA
Perchlorate SCHEMBL30042407 0.76 KDM4E (0.49) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL74712 0.75 AR (0.65) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL29379051 0.75 AR (0.65) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL11591247 0.74 NQO2 (0.44) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL28046238 0.72 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL3019661 0.68 ADORA2A (0.49) KDM4EALDH1A1HPGDHSD17B10GLA
SCHEMBL28067946 0.67 CA12 (0.53) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL11589606 0.65 ALDH1A1 (0.54) KDM4EALDH1A1HPGDHSD17B10GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115038740-A Poly (carbonate-siloxane) compositions with improved appearance 高新特殊工程塑料全球技术有限公司 2022-09-09 CN disclosed
CN-114787258-A Molded articles comprising post-consumer recycled polycarbonate and methods of making the same 高新特殊工程塑料全球技术有限公司 2022-07-22 CN disclosed
CN-114641536-A Reinforced flame retardant polycarbonate compositions with improved melt volume rate 高新特殊工程塑料全球技术有限公司 2022-06-17 CN disclosed
CN-111372778-A Panel, integrated structure and method 沙特基础工业全球技术有限公司 2020-07-03 CN disclosed