SCHEMBL29952380

SCHEMBL29952380

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

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.35
SIGMAR1 Q99720 2/20 0.33
LMNA P02545 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ATM Q13315 1/20 0.31
HSD11B1 P28845 2/20 0.30
PEPD P12955 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL2555485 0.87 POLB (0.37) KDM4ESIGMAR1ALDH1A1HSD11B1
SCHEMBL15330412 0.84 KDM4E (0.37) KDM4ESIGMAR1ALDH1A1ATMHSD11B1
SCHEMBL2562021 0.84 KDM4E (0.37) KDM4ESIGMAR1ALDH1A1ATMHSD11B1
SCHEMBL29956562 0.82 SIGMAR1 (0.38) KDM4ESIGMAR1LMNAALDH1A1ATM
SCHEMBL29956109 0.82 KDM4E (0.50) KDM4ESIGMAR1ALDH1A1HSD11B1
SCHEMBL29957083 0.81 KDM4E (0.56) KDM4ESIGMAR1LMNAALDH1A1ATM
SCHEMBL2559874 0.81 KDM4E (0.35) KDM4ESIGMAR1ALDH1A1ATMHSD11B1
SCHEMBL29957401 0.81 ALDH1A1 (0.38) KDM4ESIGMAR1LMNAALDH1A1SMN1; SMN2
SCHEMBL15332186 0.80 SIGMAR1 (0.37) KDM4ESIGMAR1ALDH1A1SMN1; SMN2
SCHEMBL2559097 0.78 KDM4E (0.36) KDM4ESIGMAR1

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 1 patent. 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