SCHEMBL9860433

SCHEMBL9860433

CCc1coc(C=O)c1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
PTPN1 P18031 1/20 0.32
PTPN11 Q06124 1/20 0.32
TTR P02766 1/20 0.31
DAO P14920 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ALOX15 P16050 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
SCHEMBL9860614 0.88 PTPN1 (0.42) MAPTPTPN1PTPN11ALOX15
SCHEMBL9861236 0.80 PTGS2 (0.32)
SCHEMBL9861242 0.77 CYP3A4 (0.41) SMN1; SMN2CYP3A4MAPTTTRALDH1A1
SCHEMBL9957129 0.75 POLB (0.39) SMN1; SMN2MAPTPTPN1PTPN11DAO
SCHEMBL19020043 0.75 CYP1A2 (0.39) SMN1; SMN2MAPTPTPN1PTPN11DAO
SCHEMBL7752798 0.72 ALDH1A1 (0.31) ALDH1A1
SCHEMBL17867311 0.70 TTR (0.35) TTR
SCHEMBL17867312 0.70 TTR (0.35) TTR
SCHEMBL11749296 0.67 ALOX15 (0.40) SMN1; SMN2MAPTPTPN11ALOX15
SCHEMBL5357961 0.66 GAA (0.39) CYP3A4MAPTALDH1A1

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
US-5061667-A REDUCED POWDERING OF POLYMER DURING POLYMERIZATION TOG NENRYO KOGYO KK (TONEN CORPORATION) (JP) 1991-10-29 US disclosed
EP-0309140-A1 Catalytic component for olefin polymerization Tonen Corporation (JP) 1989-03-29 EP disclosed