SCHEMBL8622089

SCHEMBL8622089

CON=C(C(=O)O)c1ccccc1COc1ccc(Cl)cc1C

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 7/20 0.54
HIF1A Q16665 5/20 0.53
ANO1 Q5XXA6 2/20 0.48
PTGDR2 Q9Y5Y4 1/20 0.47
ANO2 Q9NQ90 1/20 0.47
MAPT P10636 1/20 0.47
FFAR1 O14842 1/20 0.46
FFAR4 Q5NUL3 1/20 0.46

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
SCHEMBL8622088 1.00 MRGPRX4 (0.54) MRGPRX4HIF1AANO1PTGDR2ANO2
SCHEMBL8617228 0.91 HIF1A (0.53) MRGPRX4HIF1AANO1PTGDR2ANO2
Potassium Ion SCHEMBL8622774 0.91 HIF1A (0.53) MRGPRX4HIF1AANO1PTGDR2ANO2
Potassium Ion SCHEMBL8622771 0.91 HIF1A (0.53) MRGPRX4HIF1AANO1PTGDR2ANO2
SCHEMBL8617226 0.91 HIF1A (0.53) MRGPRX4HIF1AANO1PTGDR2ANO2
SCHEMBL9215724 0.90 HIF1A (0.52) MRGPRX4HIF1AANO1PTGDR2ANO2
SCHEMBL9215719 0.90 HIF1A (0.52) MRGPRX4HIF1AANO1PTGDR2ANO2
SCHEMBL8624577 0.90 MRGPRX4 (0.53) MRGPRX4HIF1AANO1PTGDR2ANO2
SCHEMBL8624580 0.90 MRGPRX4 (0.53) MRGPRX4HIF1AANO1PTGDR2ANO2
SCHEMBL8645173 0.90 MRGPRX4 (0.68) 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