SCHEMBL2559489

SCHEMBL2559489

O=Cc1c(-c2cccc([N+](=O)[O-])c2)nn(-c2ccc(F)cc2)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.42
MAPT P10636 4/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SRC P12931 1/20 0.41
BRAF P15056 1/20 0.41
KDR P35968 1/20 0.41
ALDH1A1 P00352 5/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
NPY5R Q15761 1/20 0.40
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
ATM Q13315 1/20 0.38
MAPK1 P28482 2/20 0.38
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
CYP2C8 P10632 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL2556769 0.90 MAPT (0.43) MAPTNPSR1ALDH1A1MEN1KMT2A
SCHEMBL15330924 0.90 MAPT (0.51) MAPTNPSR1ALDH1A1MEN1KMT2A
SCHEMBL15330957 0.89 PTGS1 (0.42) PTGS1MAPTSRCBRAFKDR
SCHEMBL2554295 0.89 MAPT (0.44) PTGS1MAPTNPSR1SRCBRAF
SCHEMBL2559659 0.88 MAPT (0.43) MAPTNPSR1ALDH1A1MEN1KMT2A
SCHEMBL2560068 0.87 MEN1 (0.42) PTGS1MAPTNPSR1SRCBRAF
SCHEMBL2556503 0.86 SRC (0.55) PTGS1MAPTNPSR1SRCBRAF
SCHEMBL15332097 0.86 SRC (0.55) PTGS1MAPTNPSR1SRCBRAF
SCHEMBL15331778 0.85 PTGS2 (0.40) PTGS1MAPTSRCBRAFKDR
SCHEMBL15331956 0.84 DGAT2 (0.41) PTGS1MAPTSRCBRAFKDR

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