SCHEMBL8202933

SCHEMBL8202933

CNC(=O)[C@@H](N)C(C)(C)F

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
PTGS1 P23219 1/20 0.34
DPP4 P27487 2/20 0.34
FAP Q12884 1/20 0.34
PITRM1 Q5JRX3 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34
DPP7 Q9UHL4 1/20 0.34

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
SCHEMBL8426774 1.00 MAPT (0.34) MAPTALDH1A1PTGS1DPP4FAP
SCHEMBL12867478 1.00 MAPT (0.34) MAPTALDH1A1PTGS1DPP4FAP
Hydrochloric Acid SCHEMBL1174259 0.98 DPP4 (0.33) MAPTALDH1A1PTGS1DPP4FAP
SCHEMBL25600609 0.83 MAPT (0.31) MAPTALDH1A1PTGS1DPP4
SCHEMBL17617087 0.83 MAPT (0.31) MAPTALDH1A1PTGS1DPP4
SCHEMBL19009024 0.83 MAPT (0.31) MAPTALDH1A1PTGS1DPP4
SCHEMBL1174655 0.80 DPP4 (0.50) MAPTALDH1A1PTGS1DPP4FAP
SCHEMBL342534 0.80 DPP4 (0.50) MAPTALDH1A1PTGS1DPP4FAP
SCHEMBL343358 0.80 DPP4 (0.50) MAPTALDH1A1PTGS1DPP4FAP
Trifluoroacetic Acid SCHEMBL7399856 0.79 DPP4 (0.42) MAPTALDH1A1PTGS1DPP4DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6017889-A Metalloproteinase inhibitors BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2000-01-25 US disclosed
EP-0740655-B1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARM (GB) 1999-10-20 EP disclosed
US-5902791-A TREATING RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, PERIODONTAL DISEASE, GINGIVITIS, CORNEAL ULCERATION OR TUMOR METASTASES BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1999-05-11 US disclosed
EP-0740655-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1996-11-06 EP disclosed
WO-1995019961-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1995-07-27 WO disclosed