SCHEMBL21882755

SCHEMBL21882755

CC(C)[C@H](NC(=O)C(NC(=O)CCc1ccc(Cl)c(Cl)c1)[C@@H](C)c1ccccc1)C(=O)C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTRA1 Q92743 20/20 0.49

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
SCHEMBL18055525 1.00 HTRA1 (0.49) HTRA1
SCHEMBL19665826 1.00 HTRA1 (0.49) HTRA1
SCHEMBL21882747 0.90 HTRA1 (0.60) HTRA1
SCHEMBL18055506 0.90 HTRA1 (0.60) HTRA1
SCHEMBL19665816 0.86 HTRA1 (0.64) HTRA1
SCHEMBL19665814 0.86 HTRA1 (0.64) HTRA1
SCHEMBL21882757 0.85 HTRA1 (0.54) HTRA1
SCHEMBL18055516 0.85 HTRA1 (0.54) HTRA1
SCHEMBL19665838 0.85 HTRA1 (0.54) HTRA1
SCHEMBL18039147 0.83 HTRA1 (0.39) HTRA1

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
EP-3262026-B1 NEW TRIFLUOROMETHYLPROPANAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2020-03-18 EP disclosed