SCHEMBL15330685

SCHEMBL15330685

C#CCNC(=O)COc1ccc(C=O)cc1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
ALDH1A1 P00352 10/20 0.50
POLB P06746 2/20 0.49
CTDSP1 Q9GZU7 1/20 0.49
LMNA P02545 5/20 0.48
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 2/20 0.46
HPGD P15428 3/20 0.45
MEN1 O00255 1/20 0.44
HTT P42858 1/20 0.44
TP53 P04637 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL15331745 0.91 ALDH1A1 (0.50) MAPTSMN1; SMN2ALDH1A1POLBLMNA
SCHEMBL29955385 0.89 MAPT (0.51) MAPTSMN1; SMN2ALDH1A1POLBCTDSP1
SCHEMBL29957232 0.87 ALDH1A1 (0.66) MAPTSMN1; SMN2ALDH1A1POLBCTDSP1
SCHEMBL15331542 0.85 KMT2A (0.58) MAPTSMN1; SMN2ALDH1A1POLBCTDSP1
SCHEMBL2561787 0.84 ALDH1A1 (0.64) MAPTSMN1; SMN2ALDH1A1POLBCTDSP1
SCHEMBL2559178 0.83 SMN1; SMN2 (0.50) MAPTSMN1; SMN2ALDH1A1POLBCTDSP1
SCHEMBL15330441 0.81 MAPT (0.53) MAPTSMN1; SMN2ALDH1A1POLBCTDSP1
SCHEMBL2561474 0.81 ALDH1A1 (0.45) MAPTSMN1; SMN2ALDH1A1POLBLMNA
SCHEMBL2560553 0.81 ALDH1A1 (0.67) MAPTSMN1; SMN2ALDH1A1POLBLMNA
SCHEMBL2557303 0.81 MAPT (0.52) MAPTSMN1; SMN2ALDH1A1POLBCTDSP1

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