SCHEMBL13869181

SCHEMBL13869181

C=CC(=O)OCC(COCCCCOc1ccc(-c2ccc(-c3ccc(CC)cc3)cc2)cc1)OC(=O)C=C

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.40
THRB P10828 3/20 0.39
HPGD P15428 2/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
RARA P10276 1/20 0.39
TSHR P16473 2/20 0.38
HTT P42858 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL13865601 0.95 ACACB (0.41) RARBTHRBHPGDALDH1A1LMNA
SCHEMBL13865587 0.91 THRB (0.53) RARBTHRBALDH1A1LMNASMN1; SMN2
SCHEMBL13865636 0.87 THRB (0.40) RARBTHRBHPGDALDH1A1TSHR
SCHEMBL13865621 0.85 MEN1 (0.43) THRBHPGDALDH1A1SMN1; SMN2TSHR
SCHEMBL13869185 0.85 MMP3 (0.46) THRBHPGDALDH1A1MAPT
SCHEMBL13869323 0.85 THRB (0.39) RARBTHRBRARATSHR
SCHEMBL13865645 0.83 THRB (0.43) THRBHPGDALDH1A1TSHRHTT
SCHEMBL13865607 0.83 LMNA (0.44) THRBHPGDALDH1A1LMNAMAPT
SCHEMBL13865598 0.83 LMNA (0.44) THRBHPGDALDH1A1LMNAMAPT
SCHEMBL13869676 0.83 RARB (0.47) RARBTHRBHPGDRARATSHR

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-7527746-B2 Liquid crystal polyfunctional acrylate derivative and polymer thereof CHISSO CORPORATION (JP) 2009-05-05 US disclosed