SCHEMBL29154635

SCHEMBL29154635

Cc1nc2ccccc2c(=O)n1-c1cccc(Cl)c1

nearest known ligand 0.80

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.75
SMN1; SMN2 Q16637 3/20 0.71
POLB P06746 2/20 0.68
CYP1A2 P05177 1/20 0.66
CYP2D6 P10635 1/20 0.66
CYP2C9 P11712 1/20 0.66
CYP2C19 P33261 1/20 0.66
ALOX12 P18054 1/20 0.63
ALOX15 P16050 1/20 0.61
LMNA P02545 2/20 0.61
MAPT P10636 1/20 0.59
MAPK1 P28482 1/20 0.59
L3MBTL1 Q9Y468 2/20 0.57
ALDH1A1 P00352 2/20 0.57
HPD P32754 2/20 0.56

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
SCHEMBL30726098 1.00 HSD17B10 (0.75) HSD17B10SMN1; SMN2POLBCYP1A2CYP2D6
SCHEMBL30726097 1.00 HSD17B10 (0.75) HSD17B10SMN1; SMN2POLBCYP1A2CYP2D6
SCHEMBL31196715 0.89 NPC1 (0.65) HSD17B10SMN1; SMN2POLBCYP1A2CYP2D6
SCHEMBL1962312 0.87 HSD17B10 (0.77) HSD17B10SMN1; SMN2POLBALOX12ALOX15
SCHEMBL1682746 0.86 MAPK1 (0.75) HSD17B10SMN1; SMN2POLBALOX12ALOX15
SCHEMBL30122631 0.86 MAPK1 (0.75) HSD17B10SMN1; SMN2POLBALOX12ALOX15
SCHEMBL30726096 0.86 HSD17B10 (0.75) HSD17B10SMN1; SMN2POLBALOX12ALOX15
SCHEMBL29154650 0.86 HSD17B10 (0.75) HSD17B10SMN1; SMN2POLBALOX12ALOX15
SCHEMBL4391482 0.85 MAPK1 (0.70) HSD17B10SMN1; SMN2POLBCYP1A2CYP2D6
SCHEMBL29839759 0.84 HSD17B10 (0.73) HSD17B10SMN1; SMN2POLBALOX12ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117510415-A Synthesis method of quinazolinone compound 中国人民解放军军事科学院防化研究院 2024-02-06 CN disclosed