SCHEMBL7999623

SCHEMBL7999623

[2H]N(C(C)=O)[C@H]([C]=O)CC(C)C

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
KISS1R Q969F8 4/20 0.31
RNPEP Q9H4A4 1/20 0.30
SLC7A5 Q01650 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL1006669 0.79 ALDH1A1 (0.50) ALDH1A1KISS1RRNPEPSLC7A5TDP1
SCHEMBL1006670 0.79 ALDH1A1 (0.50) ALDH1A1KISS1RRNPEPSLC7A5TDP1
SCHEMBL8720923 0.76 HDAC7 (0.33) TDP1
SCHEMBL8722926 0.72 ALDH1A1 (0.38) ALDH1A1RNPEP
SCHEMBL8583476 0.72
SCHEMBL8583480 0.72
SCHEMBL3365403 0.71 ALDH1A1 (0.55) ALDH1A1
SCHEMBL9125697 0.71 PSMB5 (0.41) ALDH1A1
SCHEMBL3834367 0.71 ALDH1A1 (0.55) ALDH1A1
SCHEMBL9125703 0.71 PSMB5 (0.41) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6297216-B1 ADMINISTERING A DIPEPTIDE DERIVATIVE TO MAMMALS SOLVO BIOTECHNOLOGY (HU) 2001-10-02 US disclosed
WO-1997022622-A1 BETIDE-SUBSTITUTED GNRH ANTAGONISTS THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1997-06-26 WO disclosed