Sugi Predict

Sugi Predict / Compounds / SCHEMBL9656173

SCHEMBL9656173

SCHEMBL9656173

CCOC(=O)C1CC2OC2CC1C(=O)OC

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PPM1B O75688 2/20 0.49
▸ PTPN1 P18031 2/20 0.49
▸ PPP1CC P36873 2/20 0.49
▸ GAA P10253 1/20 0.41
▸ CA1 P00915 8/20 0.39
▸ CA2 P00918 8/20 0.39
▸ CA12 O43570 6/20 0.39
▸ CA9 Q16790 6/20 0.39
▸ KMT2A Q03164 1/20 0.38

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
SCHEMBL4395179 0.92 PPM1B (0.55) PPM1BPTPN1PPP1CCCA1CA2
SCHEMBL4395174 0.92 PPM1B (0.55) PPM1BPTPN1PPP1CCCA1CA2
SCHEMBL16001854 0.86 CA1 (0.44) GAACA1CA2CA12CA9
SCHEMBL14671466 0.86 CA1 (0.44) GAACA1CA2CA12CA9
SCHEMBL24318092 0.86 CA1 (0.44) GAACA1CA2CA12CA9
SCHEMBL9657738 0.86 PPM1B (0.50) PPM1BPTPN1PPP1CC
SCHEMBL21000602 0.86 PPM1B (0.50) PPM1BPTPN1PPP1CC
SCHEMBL2320405 0.84 PPM1B (0.47) PPM1BPTPN1PPP1CCCA1CA2
SCHEMBL9654496 0.81 PPM1B (0.45) PPM1BPTPN1PPP1CC
SCHEMBL13935401 0.80 NAAA (0.46) PPM1BPTPN1PPP1CC

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
EP-0479166-A1 Transesterification process for preparation of cycloaliphatic epoxides UNION CARBIDE CHEMICALS AND PLASTICS COMPANY, INC. (US) 1992-04-08 — — EP disclosed