SCHEMBL7114100

SCHEMBL7114100

CCCCCCCCc1ccc(OCCOC(CS(=O)(=O)O)OCC)cc1.[NaH]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
USP2 O75604 1/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
CYP3A4 P08684 1/20 0.52
MAPK1 P28482 1/20 0.52
CASP1 P29466 1/20 0.52
KMT2A Q03164 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
SLCO1B3 Q9NPD5 1/20 0.52
SLCO1B1 Q9Y6L6 1/20 0.52
S1PR1 P21453 6/20 0.49
S1PR3 Q99500 3/20 0.44
S1PR2 O95136 2/20 0.44
PLA2G4A P47712 1/20 0.43
S1PR4 O95977 3/20 0.42
S1PR5 Q9H228 3/20 0.42
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
THRA P10827 1/20 0.41

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
SCHEMBL8679002 0.87 S1PR1 (0.47) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL4955035 0.81 MEN1 (0.56) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL9393649 0.79 S1PR1 (0.66) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL9452163 0.79 S1PR1 (0.66) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL13092689 0.79 S1PR1 (0.65) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL11794640 0.79 S1PR1 (0.65) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL5147942 0.78 MEN1 (0.67) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL4459954 0.78 MEN1 (0.67) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL20358172 0.77 S1PR1 (0.64) MEN1USP2ALDH1A1LMNACYP3A4
SCHEMBL2686941 0.77 S1PR1 (0.67) MEN1USP2ALDH1A1LMNACYP3A4

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-0750226-B1 A method for processing a silver halide color photographic light-sensitive material FUJI PHOTO FILM CO LTD (JP) 2003-10-22 EP disclosed
US-6258519-B1 MAGNETIC AND SILICA PARTICLES; HARDNESS; FATTY ACID SLIDING AGENT FUJI PHOTO FILM CO., LTD. (JP) 2001-07-10 US disclosed