SCHEMBL13038200

SCHEMBL13038200

CCCCc1ccc(C(=O)Oc2ccc(C(=O)Oc3ccc(-c4cccc(-c5ccc(OC(=O)c6ccc(OC(=O)c7ccc(CCCC)cc7)cc6)cc5)c4)cc3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 7/20 0.55
▸ MAPT P10636 5/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ TDP1 Q9NUW8 1/20 0.50
▸ MEN1 O00255 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ RARA P10276 1/20 0.49
▸ MTOR P42345 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ THRB P10828 3/20 0.48
▸ BCL2 P10415 1/20 0.46
▸ MDH1 P40925 1/20 0.46

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
SCHEMBL13038245 1.00 RARB (0.55) RARBMAPTSMN1; SMN2TDP1MEN1
SCHEMBL20527907 0.92 RARB (0.61) RARBMAPTSMN1; SMN2TDP1MEN1
SCHEMBL11547222 0.92 RARB (0.64) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL11553184 0.92 RARB (0.64) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL11549020 0.89 MAPT (0.65) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL11547226 0.89 RARB (0.60) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL12736304 0.89 RARB (0.60) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL11550115 0.89 RARB (0.60) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL11548012 0.89 RARB (0.60) RARBMAPTSMN1; SMN2MEN1ALDH1A1
SCHEMBL11555315 0.89 MAPT (0.65) RARBMAPTSMN1; SMN2MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7838089-B2 with biphenylcyclohexane-based skeleton; nematic at room temperature, improved response; paraelectric SONY CORPORATION (JP) 2010-11-23 — — US disclosed
US-7838089-B2 with biphenylcyclohexane-based skeleton; nematic at room temperature, improved response; paraelectric SONY CORPORATION (JP) 2010-11-23 — — US disclosed
US-20090168009-A1 with biphenylcyclohexane-based skeleton; nematic at room temperature, improved response; paraelectric SONY CORPORATION (JP) 2009-07-02 — — US disclosed
US-20090168009-A1 with biphenylcyclohexane-based skeleton; nematic at room temperature, improved response; paraelectric SONY CORPORATION (JP) 2009-07-02 — — US disclosed
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