SCHEMBL9641747

SCHEMBL9641747

CCCCCC(=O)Oc1c(OC)c(OC)c(OC(=O)C(C)C)c2cc(C)c(C)cc12

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 3/20 0.45
▸ ELANE P08246 1/20 0.42
▸ ALOX15 P16050 1/20 0.41
▸ LDHA P00338 1/20 0.41
▸ LDHB P07195 1/20 0.41
▸ FPR1 P21462 1/20 0.39
▸ TOP2A P11388 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ LMNA P02545 3/20 0.37
▸ PAM P19021 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ TRPV1 Q8NER1 3/20 0.36
▸ DGKA P23743 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL9643146 0.84 ABCB11 (0.52) ELANEALOX15TOP2AMAPTTRPV1
SCHEMBL9641664 0.84 ABCB11 (0.52) ELANEALOX15TOP2AMAPTTRPV1
SCHEMBL9643543 0.84 ABCB11 (0.41) AKR1B1ELANEALOX15LDHALDHB
SCHEMBL9641940 0.82 AKR1B1 (0.41) AKR1B1ALOX15LDHALDHBMAPT
SCHEMBL9642125 0.81 THRA (0.43) AKR1B1LDHALDHB
SCHEMBL9642598 0.80 GAA (0.37) ALOX15GAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL9713795 0.78 GAA (0.39) AKR1B1ELANEALOX15GAAKDM4E
SCHEMBL9641729 0.77 ABCB11 (0.37) AKR1B1ELANEALOX15LDHALDHB
SCHEMBL9642627 0.77 ALOX15 (0.43) AKR1B1ALOX15TOP2AMAPTLMNA
SCHEMBL9641652 0.76 AKR1B1 (0.43) AKR1B1ALOX15LDHALDHBLMNA

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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