SCHEMBL18822342

SCHEMBL18822342

C[C@@H](COCC(F)(F)F)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G2C Q5R387 1/20 0.40
HTT P42858 1/20 0.39
ALDH1A1 P00352 2/20 0.37
GABRR1 P24046 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
HSD17B10 Q99714 1/20 0.32
FOLH1 Q04609 2/20 0.31
NAALAD2 Q9Y3Q0 2/20 0.31
ENPEP Q07075 2/20 0.31
BLM P54132 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
SCHEMBL15910175 0.79 GABRR1 (0.46) GABRR1CYP1A2FOLH1NAALAD2ENPEP
SCHEMBL21895794 0.78
SCHEMBL18822327 0.75 NOS3 (0.43) PLA2G2CHTTALDH1A1CYP1A2BLM
SCHEMBL23935762 0.75 PGD (0.34) GABRR1CYP1A2FOLH1NAALAD2
SCHEMBL24965918 0.75 PLA2G2C (0.40) PLA2G2CHTTALDH1A1CYP2C9TSHR
SCHEMBL499938 0.74 GABRR1 (0.38) GABRR1CYP1A2FOLH1NAALAD2ENPEP
SCHEMBL28976448 0.74 GABRR1 (0.38) GABRR1CYP1A2FOLH1NAALAD2ENPEP
SCHEMBL9937135 0.73 PLA2G2C (0.39) PLA2G2CHTTALDH1A1CYP2C9TSHR
SCHEMBL15866578 0.73
SCHEMBL9872360 0.73 HSD17B10 (0.46) PLA2G2CHTTCYP2C9TSHRCYP2C19

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
WO-2017075505-A2 NOVEL POLYPEPTIDES WITH IMPROVED PROTEOLYTIC STABILITY, AND METHODS OF PREPARING AND USING SAME TUFTS UNIVERSITY (US) 2017-05-04 WO disclosed
WO-2017075522-A2 GLP-2 POLYPEPTIDES WITH IMPROVED PROTEOLYTIC STABILITY, AND METHODS OF PREPARING AND USING SAME TUFTS UNIVERSITY (US) 2017-05-04 WO disclosed