SCHEMBL15330640

SCHEMBL15330640

Cc1ccc2[nH]c(-c3ccccc3[N+](=O)[O-])c(C=O)c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.46
MAPT P10636 5/20 0.46
MEN1 O00255 4/20 0.46
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
POLB P06746 2/20 0.46
MAPK1 P28482 2/20 0.46
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.41
ALPL P05186 1/20 0.41
MAOB P27338 1/20 0.41
GAA P10253 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
PTGS2 P35354 2/20 0.40
CCNB2 O95067 1/20 0.40
CDK1 P06493 1/20 0.40

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
SCHEMBL15332286 0.85 KMT2A (0.45) KMT2AMAPTMEN1RAB9ANPC1
SCHEMBL15330017 0.85 KMT2A (0.48) KMT2AMAPTMEN1RAB9ANPC1
SCHEMBL29951989 0.82 SMN1; SMN2 (0.46) KMT2AMAPTMEN1RAB9ANPC1
SCHEMBL15331784 0.82 MEN1 (0.48) KMT2AMAPTMEN1RAB9ANPC1
SCHEMBL15330102 0.80 MAPT (0.35) KMT2AMAPTMEN1RAB9ANPC1
SCHEMBL15331165 0.80 MEN1 (0.46) KMT2AMAPTMEN1RAB9ANPC1
SCHEMBL15331730 0.80 NPC1 (0.46) KMT2AMAPTMEN1RAB9ANPC1
SCHEMBL2557296 0.80 GRIN2D (0.41) KMT2AMAPTMEN1RAB9ANPC1
SCHEMBL15332615 0.79 MGAM (0.45) KMT2AMAPTNPC1MAPK1ALDH1A1
SCHEMBL15329834 0.78 CYP19A1 (0.54) KMT2AMAPTMEN1RAB9ANPC1

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