SCHEMBL29954476

SCHEMBL29954476

Nc1cnc(F)cc1C=O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 2/20 0.32
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
UHRF1 Q96T88 1/20 0.30

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
SCHEMBL24086588 0.78 ERN1 (0.38) ERN1
SCHEMBL29953025 0.75 ERN1 (0.41) ERN1
SCHEMBL29957354 0.75 GRIA1 (0.37) ERN1
SCHEMBL29951690 0.75 TDP1 (0.38) ERN1
SCHEMBL24086660 0.75 GRIA1 (0.37) ERN1
SCHEMBL16702226 0.75 LMNA (0.39) ERN1
SCHEMBL14327941 0.75 UHRF1 (0.54) ERN1UHRF1
SCHEMBL6856975 0.75 ERN1 (0.34) ERN1UHRF1
SCHEMBL21728724 0.75 UHRF1 (0.30) ERN1UHRF1
SCHEMBL29955838 0.75 CA2 (0.41) ERN1ALOX5APFEN1

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed