SCHEMBL8618455

SCHEMBL8618455

CO/N=C(/C(=O)Cl)c1ccccc1COc1ccc(Cl)cc1Cl

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 9/20 0.65
HIF1A Q16665 5/20 0.53
ADRB2 P07550 1/20 0.49
TP53 P04637 1/20 0.47
HTT P42858 1/20 0.47
FABP3 P05413 1/20 0.44
FABP4 P15090 1/20 0.44
FABP5 Q01469 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
SCHEMBL8618459 1.00 MRGPRX4 (0.65) MRGPRX4HIF1AADRB2TP53HTT
SCHEMBL8645171 0.91 MRGPRX4 (0.68) MRGPRX4HIF1AADRB2TP53HTT
SCHEMBL8645173 0.91 MRGPRX4 (0.68) MRGPRX4HIF1AADRB2TP53HTT
SCHEMBL8371588 0.90 MRGPRX4 (0.61) MRGPRX4HIF1AADRB2TP53HTT
SCHEMBL6452979 0.90 MRGPRX4 (0.61) MRGPRX4HIF1AADRB2TP53HTT
SCHEMBL6452972 0.90 MRGPRX4 (0.61) MRGPRX4HIF1AADRB2TP53HTT
SCHEMBL8617226 0.90 HIF1A (0.53) MRGPRX4HIF1A
SCHEMBL8617209 0.90 MRGPRX4 (0.51) MRGPRX4HIF1ATP53HTT
SCHEMBL8617210 0.90 MRGPRX4 (0.51) MRGPRX4HIF1ATP53HTT
SCHEMBL8617228 0.90 HIF1A (0.53) MRGPRX4HIF1A

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