SCHEMBL17699352

SCHEMBL17699352

CCC(O)CC(C)O.CCCCCCc1ccc(C(=O)O)cc1.CCCCCCc1ccc(C(=O)O)cc1

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.67
ALDH1A1 P00352 2/20 0.67
MEN1 O00255 1/20 0.67
RARA P10276 1/20 0.67
MAPT P10636 1/20 0.67
MTOR P42345 1/20 0.67
KMT2A Q03164 1/20 0.67
THRA P10827 3/20 0.52
THRB P10828 3/20 0.52
PLA2G1B P04054 4/20 0.51
ATG4B Q9Y4P1 4/20 0.51
CYP1A2 P05177 1/20 0.51
TDP1 Q9NUW8 1/20 0.51

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
SCHEMBL17699464 0.94 RARB (0.65) RARBALDH1A1MEN1RARAMAPT
SCHEMBL17699320 0.93 RARB (0.72) RARBALDH1A1MEN1RARAMAPT
SCHEMBL17699438 0.91 RARB (0.71) RARBALDH1A1MEN1RARAMAPT
SCHEMBL17699358 0.88 RARB (0.51) RARBALDH1A1MEN1RARAMAPT
SCHEMBL14715027 0.87 RARB (0.71) RARBALDH1A1MEN1RARAMAPT
SCHEMBL568831 0.87 RARB (0.71) RARBALDH1A1MEN1RARAMAPT
SCHEMBL14690322 0.86 RARB (0.61) RARBALDH1A1MEN1RARAMAPT
SCHEMBL14690346 0.86 RARB (0.61) RARBALDH1A1MEN1RARAMAPT
SCHEMBL14715364 0.86 RARB (0.61) RARBALDH1A1MEN1RARAMAPT
SCHEMBL503648 0.85 RARB (0.90) RARBALDH1A1MEN1RARAMAPT

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-9751960-B2 Catalyst component for olefin polymerization, catalyst, and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2017-09-05 US claimed
US-20160115257-A1 Catalyst component for olefin polymerization, catalyst, and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2016-04-28 US claimed
US-9751960-B2 Catalyst component for olefin polymerization, catalyst, and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2017-09-05 US disclosed
US-20160115257-A1 Catalyst component for olefin polymerization, catalyst, and use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2016-04-28 US disclosed