SCHEMBL2556770

SCHEMBL2556770

CCCC(C)NC(=O)C(C)N1CCCC(C=O)C1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
GAA P10253 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
SIGMAR1 Q99720 2/20 0.31
HTT P42858 1/20 0.31
ALDH1A1 P00352 2/20 0.30
DPP4 P27487 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
MAPT P10636 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
HPGD P15428 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL29952135 0.91 GAA (0.39) KDM4EGAACYP2C9CYP2C19SIGMAR1
SCHEMBL20578751 0.90 SIGMAR1 (0.34) KDM4EGAACYP2C19SIGMAR1HTT
SCHEMBL2562021 0.86 KDM4E (0.37) KDM4ESIGMAR1ALDH1A1L3MBTL1
SCHEMBL2559097 0.86 KDM4E (0.36) KDM4EGAACYP2C9CYP2C19SIGMAR1
SCHEMBL15332281 0.85 SIGMAR1 (0.35) KDM4EGAASIGMAR1ALDH1A1L3MBTL1
SCHEMBL29955449 0.84 SIGMAR1 (0.40) KDM4EGAACYP2C19SIGMAR1ALDH1A1
SCHEMBL2556245 0.83 SIGMAR1 (0.41) KDM4ESIGMAR1ALDH1A1DPP4
SCHEMBL29957401 0.83 ALDH1A1 (0.38) KDM4EGAASIGMAR1ALDH1A1DPP4
SCHEMBL15330412 0.81 KDM4E (0.37) KDM4ESIGMAR1ALDH1A1
SCHEMBL15331421 0.80 DPP7 (0.40) SIGMAR1

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 6 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
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