SCHEMBL4820162

SCHEMBL4820162

CCCCCCCC1CCC(C(=O)O)(c2ccc(-c3ccc(CCC)cc3)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
RARA P10276 2/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
MTOR P42345 1/20 0.44
ITGB3 P05106 1/20 0.40
ITGA2B P08514 1/20 0.40
RARG P13631 1/20 0.39
TSHR P16473 1/20 0.38
LTB4R Q15722 1/20 0.38
LTB4R2 Q9NPC1 1/20 0.38
MCL1 Q07820 1/20 0.37
S1PR1 P21453 3/20 0.37
S1PR3 Q99500 3/20 0.37
S1PR4 O95977 2/20 0.37
S1PR5 Q9H228 2/20 0.37
HRH3 Q9Y5N1 2/20 0.37

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
SCHEMBL8035928 0.92 KMT2A (0.48) MEN1KMT2AALDH1A1ITGB3ITGA2B
SCHEMBL4827223 0.90 MEN1 (0.47) RARBMEN1KMT2ARARAALDH1A1
SCHEMBL8677395 0.87 MEN1 (0.48) RARBMEN1KMT2AALDH1A1ITGB3
SCHEMBL2829785 0.85 MEN1 (0.47) RARBMEN1KMT2ARARAALDH1A1
SCHEMBL9487875 0.84 MEN1 (0.42) MEN1KMT2AALDH1A1MAPTITGB3
SCHEMBL9486946 0.84 MEN1 (0.42) MEN1KMT2AALDH1A1MAPTITGB3
SCHEMBL9842790 0.84 MEN1 (0.40) RARBMEN1KMT2ARARAITGB3
SCHEMBL9842432 0.84 MEN1 (0.40) RARBMEN1KMT2ARARAITGB3
SCHEMBL7507869 0.83 MEN1 (0.47) MEN1KMT2AALDH1A1MAPTTSHR
SCHEMBL9429988 0.83 RARB (0.57) RARBMEN1KMT2ARARAALDH1A1

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-7335405-B2 Nematic liquid crystal mixtures for use in bistable display devices NEMOPTIC (FR) 2008-02-26 US claimed
US-20060249708-A1 Nematic liquid crystal mixtures for use in bistable display devices CDC PROPRIETE INTELLECTUELLE (FR) 2006-11-09 US claimed
US-7335405-B2 Nematic liquid crystal mixtures for use in bistable display devices NEMOPTIC (FR) 2008-02-26 US disclosed
US-20060249708-A1 Nematic liquid crystal mixtures for use in bistable display devices CDC PROPRIETE INTELLECTUELLE (FR) 2006-11-09 US disclosed