SCHEMBL29675165

SCHEMBL29675165

O=C(O)c1ccc2cccc3c4cccc5cccc(c1c23)c54

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.55
WDR5 P61964 1/20 0.53
NR4A1 P22736 1/20 0.52
NR4A2 P43354 1/20 0.52
NR4A3 Q92570 1/20 0.52
LDHA P00338 1/20 0.52
ALDH1A1 P00352 5/20 0.51
CYP1A2 P05177 4/20 0.51
KMT2A Q03164 4/20 0.51
HPGD P15428 4/20 0.51
KDM4E B2RXH2 3/20 0.51
GLA P06280 1/20 0.51
POLB P06746 1/20 0.51
CYP2D6 P10635 1/20 0.51
MEN1 O00255 3/20 0.50
TSHR P16473 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
THRB P10828 1/20 0.50
CDC25B P30305 1/20 0.46
PARP1 P09874 1/20 0.44

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
SCHEMBL781875 1.00 HSD17B10 (0.55) HSD17B10WDR5NR4A1NR4A2NR4A3
SCHEMBL28687360 0.98 HSD17B10 (0.53) HSD17B10WDR5NR4A1NR4A2NR4A3
SCHEMBL27744196 0.87 ALDH1A1 (0.63) HSD17B10WDR5NR4A1NR4A2NR4A3
SCHEMBL30423759 0.86 HSD17B10 (0.57) HSD17B10WDR5NR4A1NR4A2NR4A3
SCHEMBL27568692 0.86 HSD17B10 (0.57) HSD17B10WDR5NR4A1NR4A2NR4A3
SCHEMBL12806754 0.86 ALDH1A1 (0.52) HSD17B10WDR5NR4A1NR4A2NR4A3
SCHEMBL235518 0.86 HSD17B10 (0.57) HSD17B10WDR5NR4A1NR4A2NR4A3
SCHEMBL29627281 0.83 ALDH1A1 (0.48) HSD17B10WDR5NR4A1NR4A2NR4A3
SCHEMBL20472165 0.83 ALDH1A1 (0.48) HSD17B10WDR5NR4A1NR4A2NR4A3
SCHEMBL5424908 0.83 ALDH1A1 (0.48) HSD17B10WDR5NR4A1NR4A2NR4A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115536002-A Preparation method of starch-based hard carbon negative electrode material, negative electrode material and sodium ion battery 多氟多新能源科技有限公司 2022-12-30 CN claimed
WO-2024183538-A1 LONG-ACTING AND SUSTAINED-RELEASE PREPARATION COMPOSITION OF LUMATEPERONE AND PREPARATION METHOD THEREFOR 四川科伦药物研究院有限公司 2024-09-12 WO disclosed
CN-115536002-A Preparation method of starch-based hard carbon negative electrode material, negative electrode material and sodium ion battery 多氟多新能源科技有限公司 2022-12-30 CN disclosed
CN-114686204-A Quantum dot composite material, preparation method thereof and quantum dot light-emitting diode TCL科技集团股份有限公司 2022-07-01 CN disclosed
CN-114518808-A Touch sensing unit 三星显示有限公司 2022-05-20 CN disclosed