SCHEMBL9637211

SCHEMBL9637211

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

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PAX8 Q06710 1/20 0.46
DPP4 P27487 2/20 0.41
DPP8 Q6V1X1 2/20 0.40
DPP7 Q9UHL4 1/20 0.40
SLC15A1 P46059 1/20 0.40
MME P08473 2/20 0.36
ACE P12821 2/20 0.36
CPA1 P15085 2/20 0.36
ACE2 Q9BYF1 2/20 0.36
CTRB1 P17538 5/20 0.33
ALDH1A1 P00352 1/20 0.33
ENPEP Q07075 4/20 0.32
DPP9 Q86TI2 1/20 0.32

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
SCHEMBL16566040 0.86 DPP4 (0.44) PAX8DPP4DPP8DPP7SLC15A1
SCHEMBL2740188 0.84 DPP9 (0.42) PAX8DPP4DPP8DPP7SLC15A1
SCHEMBL9572307 0.83 SLC7A5 (0.40) PAX8DPP4DPP8DPP7SLC15A1
SCHEMBL1031751 0.80 PAX8 (0.47) PAX8DPP4DPP8DPP7SLC15A1
SCHEMBL9637257 0.80 ACE (0.53) MMEACECPA1ACE2CTRB1
SCHEMBL24581091 0.79 PAX8 (0.50) PAX8DPP4DPP8DPP7SLC15A1
SCHEMBL29160549 0.79 ALDH1A1 (0.40) MMEACECPA1ACE2ALDH1A1
SCHEMBL1657595 0.79 ALDH1A1 (0.36) MMEACECPA1ACE2ALDH1A1
SCHEMBL9638304 0.78 DPP7 (0.50) DPP4DPP8DPP7SLC15A1DPP9
SCHEMBL7306765 0.77 CYP2C9 (0.41) MMEACECPA1ACE2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0268678-B1 NOVEL 5-FLUOROURIDINE COMPOUNDS AND PROCESS FOR THEIR PREPARATION FUJI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1992-07-29 EP claimed
US-4892939-A ANTITUMOR, ANTIVIRAL AND IMMUNOSUPRESSIVE AGENTS FUJI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1990-01-09 US claimed
EP-0268678-A1 NOVEL 5-FLUOROURIDINE COMPOUNDS AND PROCESS FOR THEIR PREPARATION FUJI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-06-01 EP claimed