SCHEMBL31053643

SCHEMBL31053643

CCN1CCN(CC(=O)NO)CC1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.49
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
EGFR P00533 1/20 0.47
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 2/20 0.44
TP53 P04637 1/20 0.43
SIGMAR1 Q99720 1/20 0.41

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
SCHEMBL25128893 0.89 ALDH1A1 (0.48) KDM4EALDH1A1SIGMAR1
SCHEMBL3974897 0.89 ALDH1A1 (0.48) KDM4EALDH1A1SIGMAR1
SCHEMBL11918971 0.83 ATM (0.49) ATMKMT2AMEN1EGFRKDM4E
SCHEMBL26159924 0.83 SIGMAR1 (0.53) KMT2AMEN1KDM4EALDH1A1SIGMAR1
SCHEMBL20750014 0.83 ATM (0.49) ATMKMT2AMEN1EGFRKDM4E
SCHEMBL29315763 0.81 KDM4E (0.51) ATMKMT2AMEN1EGFRKDM4E
SCHEMBL22281364 0.80 ALDH1A1 (0.47) KMT2AALDH1A1SIGMAR1
SCHEMBL19248414 0.78 ALDH1A1 (0.61) ATMKMT2AMEN1EGFRKDM4E
SCHEMBL11930700 0.78 ALDH1A1 (0.61) ATMKMT2AMEN1EGFRKDM4E
SCHEMBL20328825 0.78 CHRM5 (0.66) ATMKMT2AMEN1EGFRKDM4E

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
CN-115151252-B Iron death inhibitor-diarylamine acetamides 维泰瑞隆有限公司 2024-08-27 CN disclosed