SCHEMBL15329943

SCHEMBL15329943

O=Cc1c(-c2ccccc2F)nn(-c2cccc([N+](=O)[O-])c2)c1Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.47
TDO2 P48775 1/20 0.47
SCN2A Q99250 1/20 0.43
RAB9A P51151 5/20 0.42
NPC1 O15118 4/20 0.42
MAPT P10636 7/20 0.41
HPGD P15428 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
GFER P55789 1/20 0.41
ALDH1A1 P00352 3/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ABHD16A O95870 1/20 0.39
HTT P42858 2/20 0.38
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL2561098 0.88 IDO1 (0.45) IDO1TDO2SCN2ARAB9ANPC1
SCHEMBL2560270 0.87 MAPT (0.46) IDO1TDO2SCN2ARAB9ANPC1
SCHEMBL15330928 0.86 SMN1; SMN2 (0.38) IDO1TDO2RAB9ANPC1MAPT
SCHEMBL15329854 0.86 MEN1 (0.38) IDO1TDO2RAB9ANPC1MAPT
SCHEMBL2562719 0.84 NPC1 (0.50) IDO1TDO2RAB9ANPC1MAPT
SCHEMBL15329476 0.84 MAPT (0.44) IDO1TDO2RAB9ANPC1MAPT
SCHEMBL15330731 0.83 IDO1 (0.43) IDO1TDO2RAB9ANPC1MAPT
SCHEMBL2559860 0.83 RAB9A (0.42) IDO1TDO2RAB9ANPC1MAPT
SCHEMBL15329948 0.83 LMNA (0.40) IDO1TDO2MAPTKMT2AALDH1A1
SCHEMBL2560291 0.81 DHODH (0.37) IDO1TDO2MAPTSMN1; SMN2KDM4E

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