SCHEMBL9514099

SCHEMBL9514099

CCCCCCc1ccc(-c2ccc(OCC(C)OCCCC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
ALDH1A1 P00352 2/20 0.50
KMT2A Q03164 2/20 0.50
USP2 O75604 1/20 0.50
LMNA P02545 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAPK1 P28482 1/20 0.50
CASP1 P29466 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
SLCO1B3 Q9NPD5 1/20 0.50
SLCO1B1 Q9Y6L6 1/20 0.50
S1PR1 P21453 3/20 0.49
TSHR P16473 1/20 0.49
HSD17B10 Q99714 1/20 0.49
S1PR4 O95977 2/20 0.48
S1PR5 Q9H228 2/20 0.48
S1PR2 O95136 1/20 0.48
S1PR3 Q99500 1/20 0.48
RARB P10826 8/20 0.48
MAPT P10636 2/20 0.48

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
SCHEMBL9514327 1.00 MEN1 (0.50) MEN1ALDH1A1KMT2AUSP2LMNA
SCHEMBL9515901 1.00 MEN1 (0.50) MEN1ALDH1A1KMT2AUSP2LMNA
SCHEMBL9512636 0.99 MEN1 (0.49) MEN1ALDH1A1KMT2AUSP2LMNA
SCHEMBL9512657 0.99 MEN1 (0.49) MEN1ALDH1A1KMT2AUSP2LMNA
SCHEMBL9512035 0.99 MEN1 (0.49) MEN1ALDH1A1KMT2AUSP2LMNA
SCHEMBL9513801 0.99 MEN1 (0.49) MEN1ALDH1A1KMT2AUSP2LMNA
SCHEMBL9512032 0.96 MEN1 (0.49) MEN1ALDH1A1KMT2AUSP2LMNA
SCHEMBL9514938 0.92 S1PR1 (0.49) MEN1ALDH1A1KMT2AUSP2LMNA
SCHEMBL95536 0.92 ALDH1A1 (0.52) MEN1ALDH1A1KMT2AUSP2LMNA
SCHEMBL9343454 0.91 RAB9A (0.53) MEN1ALDH1A1KMT2AUSP2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0277815-B1 Optically active-2-alkoxy-propyl ether and liquid crystal composition CHISSO CORP (JP) 1993-11-24 EP disclosed
US-5021191-A Ferroelectricity display elements; extremely small redution in crystal temperature region CHISSO CORPORATION (JP) 1991-06-04 US disclosed