SCHEMBL9643182

SCHEMBL9643182

CC(=O)Oc1c(Oc2ccccc2)c(Oc2ccccc2)c(OCc2ccccc2)c2cc(Cl)ccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB11 O95342 1/20 0.54
PTPN1 P18031 1/20 0.44
MAOB P27338 5/20 0.42
MAOA P21397 3/20 0.42
NR4A2 P43354 2/20 0.40
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
RXRG P48443 1/20 0.40
PKM P14618 1/20 0.39
PTGER1 P34995 2/20 0.39
SERPINE1 P05121 1/20 0.39
LMNA P02545 2/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
MPI P34949 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GLRA1 P23415 1/20 0.39

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
SCHEMBL9642959 0.89 ABCB11 (0.67) ABCB11SERPINE1LMNAHPGDKDM4E
SCHEMBL9656918 0.82 MEN1 (0.43) ABCB11NR4A2RXRARXRBRXRG
SCHEMBL9642545 0.82 ABCB11 (0.57) ABCB11LMNAHPGDKDM4EALDH1A1
SCHEMBL9643961 0.82 ABCB11 (0.57) ABCB11LMNAHPGDKDM4EALDH1A1
SCHEMBL9641736 0.81 MAPT (0.39) MAOBMAOARXRARXRBSERPINE1
SCHEMBL9643367 0.81 ABCB11 (0.48) ABCB11NR4A2LMNAHPGD
SCHEMBL9644155 0.81 ABCB11 (0.38) ABCB11NR4A2RXRARXRBRXRG
SCHEMBL9642908 0.81 ABCB11 (0.53) ABCB11LMNAHPGDKDM4EALDH1A1
SCHEMBL9643573 0.81 ABCB11 (0.53) ABCB11LMNAHPGDKDM4EALDH1A1
SCHEMBL9643532 0.80 ABCB11 (0.58) ABCB11MAOBMAOALMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0215622-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS AND PROCESS FOR MAKING THEM SYNTEX (U.S.A.) INC. (US) 1992-06-17 EP disclosed
US-4946845-A STABLE ANTIINFLAMMATORY AGENTS, LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1990-08-07 US disclosed
US-4792556-A LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed
EP-0215622-A2 Naphthalene anti-psoriatic agents and process for making them SYNTEX (U.S.A.) INC. (US) 1987-03-25 EP disclosed