SCHEMBL8081132

SCHEMBL8081132

CCCCCCCCOC(C(=O)O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
LMNA P02545 4/20 0.49
TSHR P16473 3/20 0.49
ALDH1A1 P00352 1/20 0.49
TP53 P04637 2/20 0.47
NAAA Q02083 2/20 0.47
PLA2G4B P0C869 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 1/20 0.46
GAA P10253 1/20 0.44
ASAH1 Q13510 1/20 0.44

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
SCHEMBL10639062 1.00 SMN1; SMN2 (0.51) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL8081509 1.00 SMN1; SMN2 (0.51) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL8072241 1.00 SMN1; SMN2 (0.51) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL5508979 1.00 SMN1; SMN2 (0.51) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL8081523 1.00 SMN1; SMN2 (0.51) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL2406969 0.98 SMN1; SMN2 (0.50) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL3485833 0.93 TSHR (0.46) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL9716936 0.88 NPC1 (0.49) SMN1; SMN2NPC1RAB9ALMNATSHR
SCHEMBL17724542 0.86 PPARA (0.47) SMN1; SMN2LMNAALDH1A1CYP3A4
SCHEMBL8084866 0.86 PPARA (0.47) SMN1; SMN2LMNAALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed