SCHEMBL8414356

SCHEMBL8414356

O=C(O)C(Cc1c[nH]c(C(c2ccccc2)c2ccccc2)n1)Oc1cccc2c1CCCC2

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXRB P28702 9/20 0.38
RXRA P19793 9/20 0.38
RXRG P48443 6/20 0.38
MCL1 Q07820 2/20 0.36
PTGIR P43119 2/20 0.35
PPARG P37231 3/20 0.35
PPARA Q07869 2/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
PTGES O14684 1/20 0.34
ALOX5 P09917 1/20 0.34
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL8413617 0.81 HDAC1 (0.38) RXRBRXRARXRGMCL1PTGIR
SCHEMBL8411148 0.81 RXRA (0.39) RXRBRXRARXRGMCL1PTGIR
SCHEMBL8412765 0.78 RXRA (0.37) RXRBRXRARXRGMCL1PTGIR
SCHEMBL8413682 0.78 POLB (0.43) RXRBRXRARXRGPPARGPPARA
SCHEMBL8414244 0.78 RXRA (0.44) RXRBRXRARXRGMCL1PPARG
SCHEMBL8411095 0.77 RXRA (0.36) RXRBRXRARXRGMCL1PTGIR
SCHEMBL8413481 0.77 PPARG (0.36) RXRBRXRARXRGPTGIRPPARG
SCHEMBL8410982 0.77 RXRA (0.37) RXRBRXRARXRGMCL1PTGIR
SCHEMBL8414354 0.77 RXRA (0.39) RXRBRXRARXRGMCL1PTGIR
SCHEMBL8410755 0.76 TBXAS1 (0.35) RXRBRXRARXRGMCL1PTGIR

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
US-5962439-A CARDIOVASCULAR DISORDER ONO PHARMACEUTICAL CO., LTD. (JP) 1999-10-05 US disclosed
US-5849919-A Fused benzeneoxyacetic acid derivatives which have PGI2 receptor anonist activity ONO PHARMACEUTICAL CO., LTD. (JP) 1998-12-15 US disclosed