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SCHEMBL14415088

SCHEMBL14415088

CCCCOc1ccc(N/C=C/C(=O)Oc2cc3c4cc(OC(=O)/C=C/Nc5ccc(OCCCC)cc5)c(OC(=O)/C=C/Nc5ccc(OCCCC)cc5)cc4c4cc(OC(=O)/C=C/Nc5ccc(OCCCC)cc5)c(OC(=O)/C=C/Nc5ccc(OCCCC)cc5)cc4c3cc2OC(=O)/C=C/Nc2ccc(OCCCC)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.55
▸ GAA P10253 1/20 0.55
▸ MAPT P10636 1/20 0.55
▸ NPC1 O15118 3/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ POLB P06746 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ FAAH O00519 12/20 0.44

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
SCHEMBL14282668 0.81 TP53 (0.41) —
SCHEMBL7594187 0.78 ABCG2 (0.52) —
SCHEMBL7594181 0.78 ABCG2 (0.52) —
SCHEMBL14282667 0.78 TP53 (0.48) NPC1FAAH
SCHEMBL14415077 0.77 HDAC10 (0.42) ALDH1A1FAAH
SCHEMBL14415087 0.77 PTGES (0.39) —
SCHEMBL14282665 0.75 PLK1 (0.44) ALDH1A1GAAMAPTNPC1RAB9A
SCHEMBL14415091 0.75 THRB (0.45) ALDH1A1
SCHEMBL4021875 0.71 ATM (0.51) ALDH1A1GAAMAPTNPC1RAB9A
SCHEMBL12536592 0.70 TP53 (0.63) NPC1FAAH

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
US-7273641-B2 Optically anisotropic element comprising discotic compound FUJIFILM CORPORATION (JP) 2007-09-25 — — US disclosed
US-7273641-B2 Optically anisotropic element comprising discotic compound FUJIFILM CORPORATION (JP) 2007-09-25 — — US disclosed
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