SCHEMBL9641753

SCHEMBL9641753

COc1c(OC)c(OC(=O)C(C)(C)C)c2ccccc2c1OC

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ IDO1 P14902 1/20 0.47
▸ ELANE P08246 13/20 0.46
▸ ABCB11 O95342 1/20 0.41
▸ CA12 O43570 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ HPGD P15428 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ SLC2A1 P11166 1/20 0.37

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
SCHEMBL9642833 0.98 KDM4E (0.50) KDM4EALDH1A1MAPK1SMN1; SMN2CYP1A2
SCHEMBL9641737 0.92 ABCB11 (0.53) KDM4EALDH1A1MAPK1SMN1; SMN2CYP1A2
SCHEMBL9641865 0.90 KDM4E (0.43) KDM4EALDH1A1MAPK1SMN1; SMN2CYP1A2
SCHEMBL10707074 0.88 KDM4E (0.44) KDM4EALDH1A1MAPK1SMN1; SMN2CYP1A2
SCHEMBL9643942 0.84 KCNA3 (0.47) ALDH1A1HPGD
SCHEMBL25560597 0.81 ELANE (0.49) KDM4EELANENPSR1
SCHEMBL9642495 0.81 ABCB11 (0.68) ELANEABCB11
SCHEMBL9643129 0.81 ELANE (0.37) KDM4EALDH1A1CYP1A2CYP2C9IDO1
SCHEMBL9642741 0.81 ELANE (0.43) KDM4EALDH1A1CYP1A2ELANEABCB11
SCHEMBL9642334 0.81 ABCB11 (0.68) ELANEABCB11

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 7 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 claimed
US-4946845-A STABLE ANTIINFLAMMATORY AGENTS, LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1990-08-07 — — US claimed
EP-0215622-A2 Naphthalene anti-psoriatic agents and process for making them SYNTEX (U.S.A.) INC. (US) 1987-03-25 — — EP claimed
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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