SCHEMBL7963523

SCHEMBL7963523

CC(=O)NC(C)NC([NH])=O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
KDM4E B2RXH2 2/20 0.38
CA2 P00918 1/20 0.38
PTGS1 P23219 1/20 0.38
MMP12 P39900 1/20 0.38
NFKB1 P19838 2/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
ALOX15 P16050 1/20 0.38
PTGS2 P35354 1/20 0.38
THPO P40225 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TRPV1 Q8NER1 1/20 0.31
CYP1A2 P05177 1/20 0.31

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
SCHEMBL3392039 0.86 KDM4E (0.50) ALDH1A1KDM4ECA2PTGS1MMP12
SCHEMBL10430831 0.75 KDM4E (0.35) ALDH1A1KDM4ECA2PTGS1MMP12
SCHEMBL6130977 0.75 KDM4E (0.44) ALDH1A1KDM4ECA2PTGS1MMP12
SCHEMBL14376081 0.74 KDM4E (0.38) ALDH1A1KDM4ECA2PTGS1MMP12
SCHEMBL4790427 0.72
SCHEMBL24462 0.71
SCHEMBL7963506 0.70
SCHEMBL9645322 0.70 KDM4E (0.40) ALDH1A1KDM4ECA2PTGS1MMP12
SCHEMBL26012738 0.70 CYP2C9 (0.46) ALDH1A1KDM4ECA2PTGS1MMP12
SCHEMBL2000764 0.69

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001007409-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA UK LIMITED (GB) 2001-02-01 WO claimed
WO-2001007409-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA UK LIMITED (GB) 2001-02-01 WO disclosed