SCHEMBL20149526

SCHEMBL20149526

CCC(C)c1c(F)c(F)c(N)c(F)c1F

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL17904750 0.87 PKM (0.32) ALDH1A1PKM
SCHEMBL107647 0.85 PKM (0.35) PKM
SCHEMBL24462652 0.83
SCHEMBL24462655 0.81
SCHEMBL11996901 0.80
SCHEMBL24599660 0.79
SCHEMBL18790927 0.78
SCHEMBL20370177 0.78
SCHEMBL9503297 0.78 PKM (0.32) PKM
SCHEMBL10001112 0.78 TAS1R3 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018089373-A2 STEROIDS AND PROTEIN-CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed