SCHEMBL28348357

SCHEMBL28348357

C=CC(=O)OCCCCCCCCCCCCOc1ccc(C(=O)OOC(=O)c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.61
▸ HTT P42858 3/20 0.53
▸ TDP1 Q9NUW8 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ TSHR P16473 2/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ LSS P48449 2/20 0.49
▸ PPARA Q07869 1/20 0.48
▸ POLB P06746 1/20 0.47
▸ APEX1 P27695 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ F2 P00734 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ GAA P10253 2/20 0.44
▸ HRH4 Q9H3N8 1/20 0.44
▸ PKM P14618 1/20 0.44
▸ TP53 P04637 1/20 0.43

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
SCHEMBL27588084 1.00 THRB (0.61) THRBHTTTDP1ALDH1A1TSHR
SCHEMBL1249520 0.99 THRB (0.62) THRBHTTTDP1ALDH1A1TSHR
SCHEMBL8897475 0.92 THRB (0.61) THRBHTTTDP1ALDH1A1TSHR
SCHEMBL8659363 0.92 THRB (0.61) THRBHTTTDP1ALDH1A1TSHR
SCHEMBL28348355 0.92 THRB (0.61) THRBHTTTDP1ALDH1A1TSHR
SCHEMBL16885031 0.90 THRB (0.61) THRBHTTTDP1ALDH1A1TSHR
SCHEMBL15525736 0.89 THRB (0.64) THRBHTTTDP1ALDH1A1TSHR
SCHEMBL24599283 0.88 THRB (0.63) THRBHTTTDP1ALDH1A1TSHR
SCHEMBL24599284 0.88 THRB (0.63) THRBHTTTDP1ALDH1A1TSHR
SCHEMBL5530467 0.88 THRB (0.62) THRBHTTTDP1ALDH1A1TSHR

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
CN-111718727-A Liquid crystal composition, mixture, polymer/liquid crystal composite material, optical switching element, and laser radar 捷恩智株式会社 2020-09-29 — — CN disclosed
CN-110577836-A Liquid crystal composition for light conversion element, mixture, polymer/liquid crystal composite material, element, and laser radar 捷恩智株式会社 2019-12-17 — — CN disclosed
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