SCHEMBL15329587

SCHEMBL15329587

O=C(O)CCCC(=O)Nc1ccccc1N1CCCC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.67
KCNQ2 O43526 5/20 0.67
GAA P10253 3/20 0.67
PKM P14618 1/20 0.67
NPSR1 Q6W5P4 4/20 0.62
LMNA P02545 3/20 0.62
TSHR P16473 2/20 0.62
PLA2G1B P04054 2/20 0.62
ATG4B Q9Y4P1 2/20 0.62
L3MBTL1 Q9Y468 2/20 0.61
ALDH1A1 P00352 1/20 0.59
HSD17B10 Q99714 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.58
MEN1 O00255 2/20 0.56
ATM Q13315 1/20 0.56
KDM4E B2RXH2 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
XBP1 P17861 1/20 0.56

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
SCHEMBL2555188 0.99 KMT2A (0.65) KMT2AKCNQ2GAAPKMNPSR1
SCHEMBL29951675 0.92 KCNQ2 (0.70) KMT2AKCNQ2GAAPKMNPSR1
SCHEMBL29957211 0.90 KMT2A (0.68) KMT2AKCNQ2GAAPKMNPSR1
SCHEMBL29955086 0.85 KCNQ2 (0.74) KMT2AKCNQ2GAAPKMNPSR1
SCHEMBL29957640 0.84 KMT2A (0.72) KMT2AKCNQ2GAAPKMNPSR1
SCHEMBL13167010 0.80 KCNQ2 (1.00) KMT2AKCNQ2GAAPKMNPSR1
SCHEMBL21665202 0.80 HTT (0.60) KMT2AGAAALDH1A1MEN1KDM4E
SCHEMBL4318899 0.79 KCNQ2 (0.68) KMT2AKCNQ2GAAPKMNPSR1
SCHEMBL22897679 0.78 KCNQ2 (0.68) KMT2AKCNQ2GAAPKMNPSR1
SCHEMBL29559749 0.78 KCNQ2 (0.68) KMT2AKCNQ2GAAPKMNPSR1

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