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SCHEMBL14415087

SCHEMBL14415087

CCCCOc1ccc(N(C)/C=C/C(=O)Oc2cc3c4cc(OC(=O)/C=C/N(C)c5ccc(OCCCC)cc5)c(OC(=O)/C=C/N(C)c5ccc(OCCCC)cc5)cc4c4cc(OC(=O)/C=C/N(C)c5ccc(OCCCC)cc5)c(OC(=O)/C=C/N(C)c5ccc(OCCCC)cc5)cc4c3cc2OC(=O)/C=C/N(C)c2ccc(OCCCC)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 1/20 0.39
▸ THRA P10827 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ TSHR P16473 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 0.80 TP53 (0.41) TP53TSHR
SCHEMBL14282667 0.77 TP53 (0.48) TP53TSHR
SCHEMBL7594187 0.77 ABCG2 (0.52) TP53TSHR
SCHEMBL14415088 0.77 ALDH1A1 (0.55) —
SCHEMBL7594181 0.77 ABCG2 (0.52) TP53TSHR
SCHEMBL14415077 0.76 HDAC10 (0.42) —
SCHEMBL14282665 0.74 PLK1 (0.44) —
SCHEMBL14415091 0.74 THRB (0.45) THRB
SCHEMBL14415102 0.73 KMT2A (0.38) THRATHRB
SCHEMBL12536592 0.70 TP53 (0.63) TP53TSHR

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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