SCHEMBL6682939

SCHEMBL6682939

CCC1(CC)C[C@H]2O[C@H]2CC1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 2/20 0.34
PTPN1 P18031 2/20 0.34
PPP1CC P36873 2/20 0.34
TFPI2 P48307 4/20 0.33
TP53 P04637 2/20 0.33
NFKB1 P19838 2/20 0.33
THPO P40225 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GMNN O75496 1/20 0.33
LMNA P02545 1/20 0.33
PMP22 Q01453 1/20 0.33
TSHR P16473 1/20 0.33
PPP5C P53041 3/20 0.33
PPP2CA P67775 1/20 0.33
NPY4R P50391 1/20 0.33
SLC6A4 P31645 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP2C19 P33261 1/20 0.31
STAT6 P42226 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL11518296 0.78 APLNR (0.37) KDM4ESLC6A4CYP2C19
SCHEMBL20798258 0.78 APLNR (0.37) KDM4ESLC6A4CYP2C19
SCHEMBL28184038 0.71 PPP5C (0.37) TP53NFKB1THPOGMNNLMNA
SCHEMBL16415727 0.71 HPSE (0.36) TSHRPPP5C
SCHEMBL13269289 0.70
SCHEMBL9657559 0.69 PPM1B (0.37) PPM1BPTPN1PPP1CCLMNA
SCHEMBL844684 0.68
SCHEMBL11866220 0.68 MAPK1 (0.39) PPM1BPTPN1PPP1CCTFPI2TP53
SCHEMBL4601279 0.68 MAPK1 (0.39) PPM1BPTPN1PPP1CCTFPI2TP53
SCHEMBL1948809 0.67 MAPK1 (0.30) TP53NFKB1THPOGMNNLMNA

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
EP-3122819-A1 MELT POLYMERIZATION POLYCARBONATE QUENCHING SABIC Global Technologies B.V. (NL) 2017-02-01 EP disclosed
WO-2015145381-A1 MELT POLYMERIZATION POLYCARBONATE QUENCHING SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2015-10-01 WO disclosed
EP-1476504-A1 THERMOPLACTIC RESIN COMPOSITION AND METHOD 0F IMPROVING APPEARANCE GENERAL ELECTRIC COMPANY (US) 2004-11-17 EP disclosed
WO-2003066724-A1 THERMOPLACTIC RESIN COMPOSITION AND METHOD 0F IMPROVING APPEARANCE GENERAL ELECTRIC COMPANY (US) 2003-08-14 WO disclosed