SCHEMBL9117871

SCHEMBL9117871

c1ccc(COC[C@H]2O[C@H](OC3CCCCC3)[C@H](OCc3ccccc3)[C@@H](OCc3ccccc3)[C@@H]2OCc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SSTR1 P30872 4/20 0.53
SSTR2 P30874 4/20 0.53
SSTR4 P31391 4/20 0.53
SSTR3 P32745 4/20 0.53
SSTR5 P35346 4/20 0.53
PTPN1 P18031 8/20 0.52
PTPN2 P17706 3/20 0.52
PTPN11 Q06124 3/20 0.52
GJB2 P29033 2/20 0.48
NT5E P21589 1/20 0.48
CDC25B P30305 6/20 0.46
PTPN6 P29350 2/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
ADRB2 P07550 1/20 0.45
TACR1 P25103 1/20 0.45

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
SCHEMBL9117860 1.00 SSTR1 (0.53) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL10262410 0.89 PTPN1 (0.49) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL5140251 0.88 PTPN1 (0.45) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL5140579 0.86 PTPN1 (0.44) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL10261931 0.86 PTPN1 (0.44) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL5140252 0.85 PTPN1 (0.43) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL5139347 0.84 PTPN1 (0.42) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL10261409 0.84 PTPN1 (0.42) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL5139349 0.84 PTPN1 (0.42) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL10262225 0.84 PTPN1 (0.42) SSTR1SSTR2SSTR4SSTR3SSTR5

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
JP-7033792-A None JP disclosed
JP-7242690-A None JP disclosed
JP-H07242690-A PRODUCTION OF ACETALS SUMITOMO PHARMACEUT CO LTD 1995-09-19 JP disclosed
JP-H0733792-A NEW GLYCOSYL DONOR AND METHOD OF GLYCOSYLATION ASAHI CHEM IND CO LTD 1995-02-03 JP disclosed