SCHEMBL874305

SCHEMBL874305

O=C(O)C(Cl)C(=O)C(F)(F)C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
ALDH1A1 P00352 1/20 0.33
THRB P10828 1/20 0.32

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
SCHEMBL8678258 0.79 LMNA (0.40) LMNAALDH1A1
SCHEMBL28057144 0.70 ALDH1A1 (0.42) LMNAALDH1A1
SCHEMBL882685 0.70 ALDH1A1 (0.34) LMNAALDH1A1
SCHEMBL584638 0.67
SCHEMBL891818 0.67 THRB (0.32) THRB
SCHEMBL1793066 0.66 THRB (0.41) ALDH1A1THRB
SCHEMBL1793069 0.66 THRB (0.41) ALDH1A1THRB
SCHEMBL27869640 0.65 LMNA (0.32) LMNA
SCHEMBL2988549 0.65 THRB (0.31) THRB
SCHEMBL15293930 0.65 THRB (0.35) ALDH1A1THRB

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-2012038905-A1 THIENOPYRIDINE NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-03-29 WO disclosed
WO-2012038904-A1 NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-03-29 WO disclosed