SCHEMBL17699356

SCHEMBL17699356

CCCCC(C(O)CCC)C(O)CCC.CCCCc1ccc(C(=O)O)cc1.CCCCc1ccc(C(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RARB P10826 8/20 0.63
ALDH1A1 P00352 4/20 0.56
MEN1 O00255 1/20 0.56
RARA P10276 1/20 0.56
MAPT P10636 1/20 0.56
MTOR P42345 1/20 0.56
KMT2A Q03164 1/20 0.56
HPGD P15428 1/20 0.51
HSD17B10 Q99714 1/20 0.51
PLK1 P53350 1/20 0.48
THRA P10827 2/20 0.47
THRB P10828 2/20 0.47
TRPV1 Q8NER1 1/20 0.46
NPC1 O15118 1/20 0.45
NFKB1 P19838 1/20 0.45
RAB9A P51151 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL17699439 0.91 RARB (0.63) RARBALDH1A1MEN1RARAMAPT
SCHEMBL17699411 0.87 RARB (0.69) RARBALDH1A1MEN1RARAMAPT
SCHEMBL17699329 0.86 RARB (0.65) RARBALDH1A1MEN1RARAMAPT
Benzoic Acid SCHEMBL1787666 0.85 TSHR (0.45) RARB
SCHEMBL10877876 0.84 RARB (0.86) RARBALDH1A1MEN1RARAMAPT
SCHEMBL181230 0.83 RARB (0.89) RARBALDH1A1MEN1RARAMAPT
SCHEMBL17699360 0.82 RARB (0.67) RARBALDH1A1MEN1RARAMAPT
SCHEMBL17699342 0.82 RARB (0.67) RARBALDH1A1MEN1RARAMAPT
SCHEMBL17699444 0.82 RARB (0.50) RARBALDH1A1MEN1RARAMAPT
SCHEMBL568831 0.82 RARB (0.71) 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