SCHEMBL22626523

SCHEMBL22626523

C=C/C(=C\SC)n1nc(C(=O)NCCCNC(C)=O)c2c1-c1cc(C=C(C)C)c(OC)cc1OC2

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 10/20 0.34

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
SCHEMBL22626388 0.84 TP53 (0.32) —
SCHEMBL16377938 0.78 RAD52 (0.35) NR1H4
SCHEMBL22626322 0.76 CASK (0.31) —
SCHEMBL16377775 0.75 RAD52 (0.36) NR1H4
SCHEMBL22626252 0.74 NR1H4 (0.33) NR1H4
SCHEMBL22626444 0.74 PLAT (0.31) —
SCHEMBL29670686 0.72 RAD52 (0.35) —
SCHEMBL17783208 0.71 RAD52 (0.33) —
SCHEMBL16377842 0.71 CNR1 (0.36) —
SCHEMBL16377982 0.71 RAD52 (0.37) NR1H4

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-3013832-B1 PYRAZOLE COMPOUNDS AS MODULATORS OF FSHR AND USES THEREOF MERCK PATENT GMBH (DE) 2020-11-04 — — EP disclosed
Send feedback