SCHEMBL15329476

SCHEMBL15329476

O=Cc1c(-c2ccc(F)cc2)nn(-c2cccc([N+](=O)[O-])c2)c1Br

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.44
LMNA P02545 3/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HTT P42858 2/20 0.44
SRC P12931 1/20 0.41
BRAF P15056 1/20 0.41
KDR P35968 1/20 0.41
ALDH1A1 P00352 3/20 0.41
POLB P06746 2/20 0.41
IDO1 P14902 1/20 0.41
TDO2 P48775 1/20 0.41
RAB9A P51151 4/20 0.40
NPC1 O15118 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HPGD P15428 2/20 0.40
GAA P10253 1/20 0.40
CASP3 P42574 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
PTGS1 P23219 1/20 0.39

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
SCHEMBL2559860 0.90 RAB9A (0.42) MAPTMEN1KMT2AHTTALDH1A1
SCHEMBL2562719 0.90 NPC1 (0.50) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL2560068 0.89 MEN1 (0.42) MAPTLMNAMEN1KMT2AHTT
SCHEMBL2554295 0.87 MAPT (0.44) MAPTLMNAMEN1KMT2AHTT
SCHEMBL15331337 0.86 SRC (0.55) MAPTLMNAMEN1KMT2ASRC
SCHEMBL2557102 0.86 SRC (0.55) MAPTLMNAMEN1KMT2ASRC
SCHEMBL15329943 0.84 IDO1 (0.47) MAPTLMNAMEN1KMT2AHTT
SCHEMBL15331522 0.83 MEN1 (0.52) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL2554743 0.83 POLB (0.41) LMNASRCBRAFKDRPOLB
SCHEMBL15330963 0.82 PTPN11 (0.49) MAPTLMNAMEN1KMT2ASRC

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 5 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