SCHEMBL8395204

SCHEMBL8395204

CCO/N=C(\C(=O)NC)c1ccccc1COc1ccc(Cl)cc1C

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 7/20 0.47
ANO1 Q5XXA6 3/20 0.45
ANO2 Q9NQ90 1/20 0.44
MAPT P10636 2/20 0.43
HIF1A Q16665 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.42
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 1/20 0.40
TP53 P04637 1/20 0.40
ALOX15 P16050 1/20 0.40

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
SCHEMBL8395210 1.00 MRGPRX4 (0.47) MRGPRX4ANO1ANO2MAPTHIF1A
SCHEMBL8398061 0.91 MRGPRX4 (0.47) MRGPRX4ANO1ANO2MAPTHIF1A
SCHEMBL8398055 0.91 MRGPRX4 (0.47) MRGPRX4ANO1ANO2MAPTHIF1A
SCHEMBL6457937 0.91 HIF1A (0.52) MRGPRX4ANO1ANO2MAPTHIF1A
SCHEMBL6457931 0.91 HIF1A (0.52) MRGPRX4ANO1ANO2MAPTHIF1A
SCHEMBL8369903 0.91 HIF1A (0.52) MRGPRX4ANO1ANO2MAPTHIF1A
SCHEMBL8622779 0.91 MRGPRX4 (0.50) MRGPRX4ANO1ANO2MAPTHIF1A
SCHEMBL8622780 0.91 MRGPRX4 (0.50) MRGPRX4ANO1ANO2MAPTHIF1A
SCHEMBL8624580 0.89 MRGPRX4 (0.53) MRGPRX4ANO1ANO2MAPTHIF1A
SCHEMBL8624577 0.89 MRGPRX4 (0.53) MRGPRX4ANO1ANO2MAPTHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0644183-B1 Process of producing N-alkylacetamides SHIONOGI & CO (JP) 1999-06-02 EP disclosed
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
US-5498792-A Process of producing N-alkylacetamides SHIONOGI & CO., LTD. (JP) 1996-03-12 US disclosed
EP-0658541-A1 PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE SHIONOGI & CO., LTD. (JP) 1995-06-21 EP disclosed
EP-0644183-A2 Process of producing N-alkylacetamides SHIONOGI & CO., LTD. (JP) 1995-03-22 EP disclosed