SCHEMBL9641636

SCHEMBL9641636

CCCCC(=O)Oc1c(OC)c(OC)c(OC(=O)C(C)(C)C)c2ccc(C)cc12

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ABCB11 O95342 1/20 0.38
▸ TP53 P04637 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ KMT2A Q03164 4/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ ELANE P08246 5/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ RECQL P46063 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ LDHA P00338 1/20 0.33
▸ LDHB P07195 1/20 0.33
▸ AKR1B1 P15121 1/20 0.33
▸ TOP2A P11388 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
SCHEMBL9643316 1.00 ABCB11 (0.38) ABCB11TP53MAPTKMT2AMEN1
SCHEMBL9643222 0.87 ABCB11 (0.39) ABCB11TP53MAPTKMT2AMEN1
SCHEMBL9642611 0.87 ABCB11 (0.39) ABCB11TP53MAPTKMT2AMEN1
SCHEMBL9642527 0.86 ABCB11 (0.48) ABCB11TP53MAPTKMT2AELANE
SCHEMBL9642789 0.81 ABCB11 (0.43) ABCB11MAPTKMT2AGAATDP1
SCHEMBL9642672 0.81 ABCB11 (0.43) ABCB11MAPTKMT2AGAATDP1
SCHEMBL9643120 0.81 AKR1B1 (0.37) ABCB11KMT2AGAAELANEKDM4E
SCHEMBL9643310 0.81 ABCB11 (0.58) ABCB11MAPTKMT2AGAAL3MBTL1
SCHEMBL9642383 0.81 ABCB11 (0.58) ABCB11MAPTKMT2AGAAL3MBTL1
SCHEMBL23271805 0.80 KDM4E (0.47) TP53MAPTKMT2AMEN1GAA

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
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