SCHEMBL5017443

SCHEMBL5017443

N#Cc1c(-c2cccc(C(=O)NCCNC(=O)O)c2)cc(-c2ccc(F)cc2O)nc1NC(=O)c1cccs1

nearest known ligand 0.72

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KISS1R Q969F8 20/20 0.72

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
SCHEMBL13801720 0.92 KISS1R (0.84) KISS1R
Hydrochloric Acid SCHEMBL4205722 0.92 KISS1R (0.83) KISS1R
SCHEMBL4204229 0.90 KISS1R (0.82) KISS1R
SCHEMBL4200008 0.88 KISS1R (0.64) KISS1R
SCHEMBL5015403 0.88 KISS1R (0.58) KISS1R
SCHEMBL4206336 0.87 KISS1R (0.69) KISS1R
SCHEMBL13801719 0.86 KISS1R (0.75) KISS1R
SCHEMBL4205744 0.86 KISS1R (0.63) KISS1R
Hydrochloric Acid SCHEMBL4197551 0.85 KISS1R (0.74) KISS1R
Hydrochloric Acid SCHEMBL4200166 0.85 KISS1R (0.62) KISS1R

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-1921066-A1 PYRIDYLPHENOL COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2008-05-14 EP disclosed