SCHEMBL8622118

SCHEMBL8622118

CON=C(C(=O)O)c1ccc(COc2ccccc2C)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 7/20 0.67
RXRB P28702 6/20 0.67
RXRG P48443 5/20 0.67
ATM Q13315 1/20 0.51
RAB9A P51151 3/20 0.51
MAPT P10636 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
LMNA P02545 1/20 0.51
NPC1 O15118 2/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CASP3 P42574 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
FFAR4 Q5NUL3 1/20 0.45
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL8622117 1.00 RXRA (0.67) RXRARXRBRXRGATMRAB9A
SCHEMBL4427849 0.89 RXRA (0.61) RXRARXRBRXRGATMRAB9A
SCHEMBL8622185 0.89 RXRA (0.61) RXRARXRBRXRGATMRAB9A
SCHEMBL8622187 0.89 RXRA (0.61) RXRARXRBRXRGATMRAB9A
SCHEMBL7089209 0.89 RXRA (0.61) RXRARXRBRXRGATMRAB9A
SCHEMBL8205301 0.89 RXRA (0.61) RXRARXRBRXRGATMRAB9A
SCHEMBL8619481 0.86 RXRA (0.59) RXRARXRBRXRGATMRAB9A
SCHEMBL8618926 0.86 MRGPRX4 (0.55) RXRARXRBRXRGRAB9ANPC1
SCHEMBL8618929 0.86 MRGPRX4 (0.55) RXRARXRBRXRGRAB9ANPC1
SCHEMBL7221378 0.86 RXRA (0.59) RXRARXRBRXRGATMRAB9A

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 2 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