SCHEMBL15381941

SCHEMBL15381941

CCC(/C=C/C(C)=O)=C\C(=O)C[C@H](C)C[C@@H](C)CC[C@H](O)[C@H](C)C(=O)C[C@@H](O)[C@H](C)[C@@H](C)OC(=O)C[C@@H](O)C1=C(C)C(=O)OC1=O

nearest known ligand 0.90

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPP2CA P67775 7/20 0.90
PPP5C P53041 2/20 0.86
ALDH1A1 P00352 1/20 0.86
THRB P10828 1/20 0.86
HPGD P15428 1/20 0.86
PPP1CC P36873 1/20 0.86
PTPN11 Q06124 2/20 0.76
PTPA Q15257 2/20 0.36
PTPN1 P18031 1/20 0.36

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
SCHEMBL15382081 0.95 PPP2CA (1.00) PPP2CAPPP5CALDH1A1THRBHPGD
SCHEMBL889228 0.94 PPP2CA (0.80) PPP2CAPPP5CALDH1A1THRBHPGD
SCHEMBL15445020 0.92 PPP2CA (1.00) PPP2CAPPP5CALDH1A1THRBHPGD
SCHEMBL817509 0.92 PPP2CA (1.00) PPP2CAPPP5CALDH1A1THRBHPGD
SCHEMBL15381940 0.90 PPP2CA (0.90) PPP2CAPPP5CALDH1A1THRBHPGD
SCHEMBL15444945 0.90 PPP2CA (0.90) PPP2CAPPP5CALDH1A1THRBHPGD
SCHEMBL15381939 0.90 PPP2CA (0.90) PPP2CAPPP5CALDH1A1THRBHPGD
SCHEMBL15444944 0.90 PPP2CA (0.90) PPP2CAPPP5CALDH1A1THRBHPGD
SCHEMBL15381936 0.87 PPP2CA (0.86) PPP2CAPPP5CALDH1A1THRBHPGD
SCHEMBL15381932 0.85 PPP2CA (1.00) PPP2CAPPP5CALDH1A1THRBHPGD

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-8637684-B2 Tautomycetin and tautomycetin analog biosynthesis WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2014-01-28 US disclosed
US-8580977-B2 Tautomycetin and tautomycetin analog biosynthesis WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2013-11-12 US disclosed