SCHEMBL2557734

SCHEMBL2557734

CCCC(C)NC(=O)COc1ccc(C=O)cc1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.70
LMNA P02545 2/20 0.70
THRB P10828 1/20 0.70
ALDH1A1 P00352 7/20 0.68
KMT2A Q03164 2/20 0.68
L3MBTL1 Q9Y468 1/20 0.68
POLB P06746 1/20 0.49
KDM4E B2RXH2 2/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL29952888 0.89 ALDH1A1 (0.60) SMN1; SMN2LMNATHRBALDH1A1KMT2A
SCHEMBL2557857 0.85 LMNA (0.57) SMN1; SMN2LMNATHRBALDH1A1KMT2A
SCHEMBL6539276 0.84 ALDH1A1 (0.64) SMN1; SMN2LMNATHRBALDH1A1L3MBTL1
SCHEMBL2556150 0.84 ALDH1A1 (0.57) SMN1; SMN2LMNATHRBALDH1A1KMT2A
SCHEMBL15332475 0.82 KDM4E (0.60) SMN1; SMN2LMNATHRBALDH1A1KMT2A
SCHEMBL15331535 0.82 SMN1; SMN2 (0.68) SMN1; SMN2LMNATHRBALDH1A1KDM4E
SCHEMBL2558218 0.81 ALDH1A1 (0.57) SMN1; SMN2LMNATHRBALDH1A1KMT2A
SCHEMBL2554827 0.78 ALDH1A3 (0.47) SMN1; SMN2LMNATHRBALDH1A1KMT2A
SCHEMBL6538501 0.78 TSHR (0.61) ALDH1A1KMT2AKDM4E
SCHEMBL2555132 0.77 ALDH1A1 (0.59) SMN1; SMN2ALDH1A1KDM4E

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