SCHEMBL2560604

SCHEMBL2560604

CC(=O)c1ccccc1NC(=O)CNCC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.57
CA2 P00918 2/20 0.57
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 2/20 0.46
PDK1 Q15118 1/20 0.46
PDK2 Q15119 1/20 0.46
PDK3 Q15120 1/20 0.46
PDK4 Q16654 1/20 0.46
CYP2C19 P33261 1/20 0.45
HTT P42858 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL15330325 0.90 CA1 (0.51) CA1CA2KMT2AALDH1A1KDM4E
SCHEMBL14397889 0.84 CYP2C19 (0.57) KMT2AKDM4EL3MBTL1CYP2C19NPC1
SCHEMBL14397898 0.83 KMT2A (0.58) KMT2AALDH1A1KDM4EL3MBTL1POLB
SCHEMBL7652591 0.81 MAPK1 (0.56) KMT2AKDM4ECYP2C19HTTNPC1
SCHEMBL4650357 0.80 KMT2A (0.59) KMT2AALDH1A1KDM4EL3MBTL1POLB
SCHEMBL29956156 0.79 ITGB3 (0.67) KMT2AALDH1A1KDM4EL3MBTL1POLB
SCHEMBL31570129 0.78 KMT2A (0.59) KMT2AALDH1A1KDM4EL3MBTL1PDK1
SCHEMBL690246 0.78 KDM4E (0.53) KMT2AALDH1A1KDM4EL3MBTL1POLB
SCHEMBL5189053 0.78 ALDH1A1 (0.62) KMT2AALDH1A1KDM4EL3MBTL1POLB
SCHEMBL2556746 0.78 KMT2A (0.46) KMT2AALDH1A1KDM4EL3MBTL1POLB

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 7 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
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed