SCHEMBL7411986

SCHEMBL7411986

CCCC[C@H](N)C(=O)N1CCC[C@H]1C(N)=S

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 12/20 0.62
DPP7 Q9UHL4 8/20 0.62
DPP8 Q6V1X1 7/20 0.62
DPP9 Q86TI2 6/20 0.62
FAP Q12884 5/20 0.62
METAP1 P53582 1/20 0.46
PEPD P12955 1/20 0.44
ACE P12821 2/20 0.41
REN P00797 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
SCHEMBL22872683 0.89 DPP4 (0.65) DPP4DPP7DPP8DPP9FAP
Hydrochloric Acid SCHEMBL7409750 0.88 DPP4 (0.64) DPP4DPP7DPP8DPP9FAP
Bromide SCHEMBL7279605 0.88 DPP4 (0.64) DPP4DPP7DPP8DPP9FAP
SCHEMBL556799 0.86 DPP4 (0.65) DPP4DPP7DPP8DPP9FAP
Hydrochloric Acid SCHEMBL11330390 0.83 DPP4 (0.57) DPP4DPP7DPP8DPP9FAP
SCHEMBL17887962 0.82 DPP4 (0.60) DPP4DPP7DPP8DPP9FAP
SCHEMBL23380928 0.81 DPP4 (0.56) DPP4DPP7DPP8DPP9FAP
SCHEMBL22430951 0.81 DPP4 (0.56) DPP4DPP7DPP8DPP9FAP
SCHEMBL31472962 0.80 DPP4 (0.55) DPP4DPP7DPP8DPP9FAP
SCHEMBL12420345 0.79 DPP4 (0.56) DPP4DPP7DPP8DPP9FAP

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-5244884-A Tripeptide THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1993-09-14 US claimed