SCHEMBL2557751

SCHEMBL2557751

Nc1cc(C=O)c(-c2ccccc2F)cn1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 11/20 0.43
ALOX5AP P20292 9/20 0.43
BACE1 P56817 1/20 0.40
ERN1 O75460 1/20 0.39
MAP4K4 O95819 1/20 0.38
NPC1 O15118 1/20 0.38
PDPK1 O15530 1/20 0.37
USP7 Q93009 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL15331733 0.88 FEN1 (0.39) FEN1ALOX5APBACE1ERN1NPC1
SCHEMBL2553149 0.81 ALOX5AP (0.45) FEN1ALOX5APBACE1ERN1ALDH1A1
SCHEMBL29955163 0.79 FGFR1 (0.47) FEN1ALOX5APMAP4K4NPC1PDPK1
SCHEMBL2560097 0.77 ALOX5AP (0.48) FEN1ALOX5AP
SCHEMBL2562642 0.76 ALOX5AP (0.44) FEN1ALOX5APMAP4K4NPC1USP7
SCHEMBL2552689 0.76 ALOX5AP (0.42) FEN1ALOX5APMAP4K4KDM4E
SCHEMBL29952510 0.76 ALOX5AP (0.39) FEN1ALOX5APERN1PDPK1
SCHEMBL29955230 0.76 ALOX5AP (0.38) FEN1ALOX5AP
SCHEMBL2558231 0.74 ERN1 (0.47) FEN1ALOX5APBACE1ERN1MAP4K4
SCHEMBL17872367 0.72 FEN1 (0.47) FEN1ALOX5APBACE1MAP4K4NPC1

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 7 patents. 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
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed