SCHEMBL2556769

SCHEMBL2556769

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.43
NPSR1 Q6W5P4 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 3/20 0.41
KEAP1 Q14145 3/20 0.40
NFE2L2 Q16236 3/20 0.40
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2D6 P10635 1/20 0.39
HPGD P15428 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
GFER P55789 1/20 0.39
POLB P06746 1/20 0.38
ATM Q13315 1/20 0.38
LMNA P02545 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
SCHEMBL2559659 0.96 MAPT (0.43) MAPTNPSR1MEN1KMT2AALDH1A1
SCHEMBL2559489 0.90 PTGS1 (0.42) MAPTNPSR1MEN1KMT2AALDH1A1
SCHEMBL15329873 0.90 CYP1A2 (0.44) MAPTALDH1A1RAB9ACYP1A2CYP2C19
SCHEMBL15330924 0.89 MAPT (0.51) MAPTNPSR1MEN1KMT2AALDH1A1
SCHEMBL15330957 0.88 PTGS1 (0.42) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL2554295 0.88 MAPT (0.44) MAPTNPSR1MEN1KMT2AALDH1A1
SCHEMBL29956177 0.88 ESR1 (0.38) KMT2AALDH1A1CYP1A2CYP2C19CYP3A4
SCHEMBL2560438 0.87 RAB9A (0.50) MAPTNPSR1MEN1KMT2AALDH1A1
SCHEMBL2559025 0.84 KMT2A (0.39) MAPTMEN1KMT2ARAB9ANPC1
SCHEMBL15329733 0.84 POLB (0.40) NPSR1ALDH1A1RAB9ANPC1SMN1; SMN2

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