SCHEMBL14282665

SCHEMBL14282665

CCCOc1ccc(OC/C=C/C(=O)Oc2cc3c4cc(OC(=O)/C=C/COc5ccc(OCCC)cc5)c(OC(=O)/C=C/COc5ccc(OCCC)cc5)cc4c4cc(OC(=O)/C=C/COc5ccc(OCCC)cc5)c(OC(=O)/C=C/COc5ccc(OCCC)cc5)cc4c3cc2OC(=O)/C=C/COc2ccc(OCCC)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 1/20 0.44
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ LMNA P02545 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.40
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ LTA4H P09960 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ DPP4 P27487 2/20 0.38
▸ ERN1 O75460 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ PTGS1 P23219 1/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38

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 0.95 TP53 (0.41) ABCG2CYP1A2
SCHEMBL14282667 0.91 TP53 (0.48) LMNANPC1
SCHEMBL14282666 0.89 POLB (0.42) PLK1LMNAALDH1A1MAPTKMT2A
SCHEMBL14282677 0.87 THRB (0.49) PLK1L3MBTL1LMNAALDH1A1MAPT
SCHEMBL14282674 0.84 ALDH1A1 (0.51) L3MBTL1ALDH1A1MAPTHTTNPC1
SCHEMBL14282672 0.81 THRB (0.46) L3MBTL1ALDH1A1HTT
SCHEMBL14282673 0.81 THRB (0.46) L3MBTL1ALDH1A1MAPTHTT
SCHEMBL14318647 0.80 AKR1C3 (0.39) PLK1LMNAGAAMAPTKMT2A
SCHEMBL14318648 0.79 ADRB2 (0.35) ALDH1A1ABCG2KMT2AMEN1LTA4H
SCHEMBL14282676 0.77 THRB (0.44) LMNAALDH1A1MAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7314654-B2 Optically anisotropic element comprising discotic compound FUJIFILM CORPORATION (JP) 2008-01-01 — — US disclosed
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