SCHEMBL4353097

SCHEMBL4353097

[CH2]CCCCC(=O)OC1CCCC([S])CCC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.44
CYP2C19 P33261 1/20 0.35
HTT P42858 1/20 0.33
CYP19A1 P11511 2/20 0.33
TPSAB1 Q15661 2/20 0.31
TPSD1 Q9BZJ3 2/20 0.31
TPSG1 Q9NRR2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
TSHR P16473 1/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
EPHX1 P07099 1/20 0.30

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
SCHEMBL4359405 0.98 NAAA (0.55) NAAASMN1; SMN2CYP2C19HTTCYP19A1
SCHEMBL4350706 0.98 NAAA (0.55) NAAASMN1; SMN2CYP2C19HTTCYP19A1
SCHEMBL4354334 0.98 NAAA (0.55) NAAASMN1; SMN2CYP2C19HTTCYP19A1
SCHEMBL4352953 0.98 NAAA (0.55) NAAASMN1; SMN2CYP2C19HTTCYP19A1
SCHEMBL4358373 0.98 NAAA (0.55) NAAASMN1; SMN2CYP2C19HTTCYP19A1
SCHEMBL4359546 0.98 NAAA (0.55) NAAASMN1; SMN2CYP2C19HTTCYP19A1
SCHEMBL7694069 0.92 NAAA (0.61) NAAASMN1; SMN2CYP2C19HTTCYP19A1
SCHEMBL7692752 0.90 NAAA (0.64) NAAASMN1; SMN2CYP2C19HTTCYP19A1
SCHEMBL4350892 0.88 NAAA (0.45) NAAASMN1; SMN2CYP2C19HTTCYP19A1
SCHEMBL7693067 0.88 NAAA (0.66) NAAASMN1; SMN2CYP2C19HTTCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009142094-A1 POLYETHER POLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-26 WO disclosed