SCHEMBL9713474

SCHEMBL9713474

CCc1c(OC)c(OC(=O)c2ccc(C)cc2)c2cc(C)c(C)cc2c1OC(=O)c1ccc(C)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ NOD2 Q9HC29 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.41
▸ CYP1A2 P05177 2/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ AKR1C3 P42330 2/20 0.37
▸ AKR1C2 P52895 2/20 0.37
▸ MAPT P10636 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
SCHEMBL9713795 0.77 GAA (0.39) KMT2AALDH1A1CYP2C19GAANPSR1
SCHEMBL9713598 0.73 GAA (0.40) KMT2AALDH1A1NOD2TDP1NPC1
SCHEMBL16604884 0.68 ESR1 (0.44) KMT2AALDH1A1NOD2TDP1CYP1A2
SCHEMBL11037114 0.68 GAA (0.36) KMT2AALDH1A1GAANPSR1MEN1
SCHEMBL31321661 0.68 MAPT (0.56) KMT2AALDH1A1TDP1HPGDL3MBTL1
SCHEMBL9629261 0.68 ABCB11 (0.54) ALDH1A1NPC1HPGDRAB9ASMN1; SMN2
SCHEMBL9643555 0.67 ALDH1A1 (0.44) KMT2AALDH1A1HPGDSMN1; SMN2GAA
SCHEMBL29371748 0.67 KMT2A (0.53) KMT2AALDH1A1NOD2TDP1CYP1A2
SCHEMBL9629394 0.67 KDM4E (0.56) KMT2AALDH1A1CYP1A2CYP2C9NPC1
SCHEMBL23152131 0.67 ALDH1A1 (0.60) KMT2AALDH1A1NOD2TDP1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5091558-A Topical administeration SYNTEX (U.S.A.) INC. (US) 1992-02-25 — — US disclosed
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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