SCHEMBL10705899

SCHEMBL10705899

CC(C)Oc1cc(OC(=O)C(C)(C)C)c2ccccc2c1OC(=O)C(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 13/20 0.44
▸ HTT P42858 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.39
▸ ACHE P22303 1/20 0.39
▸ IRAK4 Q9NWZ3 2/20 0.38
▸ ESR1 P03372 1/20 0.38
▸ LMNA P02545 2/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL9627630 0.84 ELANE (0.47) ELANEHTTALDH1A1ESR1LMNA
SCHEMBL10710043 0.83 ELANE (0.41) ELANEHTTALDH1A1LMNACYP3A4
SCHEMBL9627634 0.81 HTT (0.63) HTTALDH1A1ACHEIRAK4ESR1
SCHEMBL10704405 0.81 ELANE (0.45) ELANEHTTALDH1A1ESR1LMNA
SCHEMBL9627373 0.81 ELANE (0.44) ELANEHTTALDH1A1LMNACYP3A4
SCHEMBL10703543 0.80 HTT (0.43) ELANEHTTALDH1A1ACHEIRAK4
SCHEMBL9628421 0.80 ELANE (0.45) ELANEHTTALDH1A1ESR1
SCHEMBL10705564 0.79 HTT (0.42) ELANEHTTALDH1A1ACHEIRAK4
SCHEMBL10704565 0.78 CNR1 (0.42) ELANEHTTALDH1A1LMNACYP3A4
SCHEMBL9627462 0.78 ELANE (0.47) ELANEHTTALDH1A1

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
EP-0150831-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS SYNTEX (U.S.A.) INC. (US) 1988-08-10 — — EP disclosed
EP-0150831-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1985-08-07 — — EP disclosed
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