SCHEMBL14924682

SCHEMBL14924682

CC(C)/C(C=O)=C\c1ccc(CO)c(CO)c1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 2/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
NFKB1 P19838 1/20 0.31
MMP8 P22894 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
SCHEMBL222375 0.76 KDM4E (0.52) MMP2MMP9NFKB1
SCHEMBL221188 0.76 KDM4E (0.52) MMP2MMP9NFKB1
SCHEMBL2601956 0.74 KDM4E (0.46)
SCHEMBL13644404 0.73 ALDH1A1 (0.43)
SCHEMBL21294258 0.73 CYP2A6 (0.46)
SCHEMBL13644405 0.73 ALDH1A1 (0.43)
SCHEMBL21294259 0.73 CYP2A6 (0.46)
SCHEMBL2564338 0.72 ALDH1A1 (0.56)
SCHEMBL2564332 0.72 ALDH1A1 (0.56)
SCHEMBL11261129 0.71 ALDH1A1 (0.55)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10035988-B2 Enone reductases CODEXIS, INC. (US) 2018-07-31 US disclosed
US-20170175087-A1 ENONE REDUCTASES INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2017-06-22 US disclosed
US-9617568-B2 Enone reductases CODEXIS, INC. (US) 2017-04-11 US disclosed
US-20160273007-A1 ENONE REDUCTASES INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2016-09-22 US disclosed
US-9388438-B2 Enone reductases CODEXIS, INC. (US) 2016-07-12 US disclosed
US-20150315613-A1 ENONE REDUCTASES INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2015-11-05 US disclosed
US-9121045-B2 Enone reductases CODEXIS, INC. (US) 2015-09-01 US disclosed
US-20150031095-A1 ENONE REDUCTASES INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2015-01-29 US disclosed
US-8883475-B2 Enone reductases CODEXIS, INC. (US) 2014-11-11 US disclosed
US-20130115663-A1 ENONE REDUCTASES CODEXIS, INC. (US) 2013-05-09 US disclosed