SCHEMBL8843372

SCHEMBL8843372

Cn1nnnc1CC(NCc1ccccc1)C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 4/20 0.41
TRPV1 Q8NER1 2/20 0.41
HDAC1 Q13547 2/20 0.41
HDAC6 Q9UBN7 2/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PSMB5 P28074 1/20 0.38
TACR1 P25103 1/20 0.38

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
SCHEMBL8843065 0.79 ALDH1A1 (0.40) DAGLATRPV1ALDH1A1PSMB5TACR1
SCHEMBL9706212 0.78 EPHX1 (0.51) PSMB5
SCHEMBL8843830 0.78 EPHX1 (0.51) PSMB5
SCHEMBL8843375 0.74 HDAC6 (0.45) HDAC1HDAC6ALDH1A1LMNA
SCHEMBL8843541 0.73 MC5R (0.39) PSMB5
SCHEMBL19450068 0.73 POLB (0.51) PSMB5
Hydrochloric Acid SCHEMBL8844340 0.73 SIRT2 (0.46) LMNA
SCHEMBL4849385 0.72 HDAC1 (0.49) HDAC1HDAC6ALDH1A1LMNAHTT
SCHEMBL5653982 0.72 PDCD1 (0.49) ALDH1A1
SCHEMBL1576808 0.72 PDCD1 (0.49) ALDH1A1

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-5672615-A MATRIX-DEGRADING METALLOPROTEINASE INHIBITORS NOVARTIS CORPORATION (US) 1997-09-30 US disclosed