SCHEMBL8618372

SCHEMBL8618372

CCc1ccccc1OCc1ccccc1C(=NOC)C(=O)Cl

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.50
TP53 P04637 1/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 4/20 0.41
ALDH1A1 P00352 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SGMS2 Q8NHU3 1/20 0.39
FOLH1 Q04609 1/20 0.38
HPGD P15428 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL8618371 1.00 HIF1A (0.50) HIF1ATP53HTTL3MBTL1ALDH1A1
SCHEMBL8619363 0.91 HIF1A (0.47) HIF1ATP53HTTALDH1A1MRGPRX4
SCHEMBL8619361 0.91 HIF1A (0.47) HIF1ATP53HTTALDH1A1MRGPRX4
SCHEMBL8618566 0.90 HIF1A (0.56) HIF1ATP53HTTNPSR1HPGD
SCHEMBL8618563 0.90 HIF1A (0.56) HIF1ATP53HTTNPSR1HPGD
SCHEMBL7664003 0.89 HIF1A (0.49) HIF1ATP53HTTALDH1A1MAPT
SCHEMBL7664008 0.89 HIF1A (0.49) HIF1ATP53HTTALDH1A1MAPT
SCHEMBL8622454 0.88 HIF1A (0.52) HIF1ATP53HTTL3MBTL1ALDH1A1
SCHEMBL8622450 0.88 HIF1A (0.52) HIF1ATP53HTTL3MBTL1ALDH1A1
SCHEMBL8396069 0.88 HIF1A (0.51) HIF1ATP53HTTL3MBTL1ALDH1A1

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
EP-0658541-B1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO (JP) 1998-05-20 EP disclosed
US-5510506-A Process for producing carboxylic acid derivatives SHIONOGI & CO., LTD. (JP) 1996-04-23 US disclosed
EP-0658541-A1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO., LTD. (JP) 1995-06-21 EP disclosed