SCHEMBL8622185

SCHEMBL8622185

CO/N=C(/C(=O)Cl)c1ccc(COc2ccccc2C)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 5/20 0.61
RXRB P28702 4/20 0.61
RXRG P48443 3/20 0.61
RAB9A P51151 3/20 0.50
MAPT P10636 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
LMNA P02545 1/20 0.50
ATM Q13315 1/20 0.47
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
HPGD P15428 2/20 0.45
NPC1 O15118 2/20 0.44
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CASP3 P42574 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 2/20 0.42

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
SCHEMBL8622187 1.00 RXRA (0.61) RXRARXRBRXRGRAB9AMAPT
SCHEMBL8622117 0.89 RXRA (0.67) RXRARXRBRXRGRAB9AMAPT
SCHEMBL8622118 0.89 RXRA (0.67) RXRARXRBRXRGRAB9AMAPT
SCHEMBL7221378 0.88 RXRA (0.59) RXRARXRBRXRGRAB9AMAPT
SCHEMBL8619481 0.88 RXRA (0.59) RXRARXRBRXRGRAB9AMAPT
SCHEMBL7089209 0.88 RXRA (0.61) RXRARXRBRXRGRAB9AMAPT
SCHEMBL8205301 0.88 RXRA (0.61) RXRARXRBRXRGRAB9AMAPT
SCHEMBL4427849 0.88 RXRA (0.61) RXRARXRBRXRGRAB9AMAPT
SCHEMBL8624710 0.87 MRGPRX4 (0.51) RXRARXRBRXRGRAB9AHPGD
SCHEMBL8624707 0.87 MRGPRX4 (0.51) RXRARXRBRXRGRAB9AHPGD

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