SCHEMBL6944682

SCHEMBL6944682

CC(N)C(=O)ON1CCCC1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.33
FAP Q12884 2/20 0.33
DPP7 Q9UHL4 2/20 0.33
PREP P48147 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33

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
SCHEMBL4955995 1.00 DPP4 (0.33) DPP4FAPDPP7PREPDPP8
SCHEMBL5856414 0.98 DPP7 (0.33) DPP4FAPDPP7PREPDPP8
SCHEMBL691381 0.83 SLC7A5 (0.38) DPP4FAPDPP7PREPDPP8
SCHEMBL5074820 0.82 ALDH1A1 (0.31)
SCHEMBL27173938 0.82 CHRM5 (0.36)
SCHEMBL28066960 0.82 ALDH1A1 (0.41)
SCHEMBL11887150 0.80 ALDH1A1 (0.32)
SCHEMBL5874768 0.80 ALDH1A1 (0.32)
SCHEMBL15153153 0.80 ALDH1A1 (0.32)
SCHEMBL7718861 0.78 ALDH1A1 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0773941-B1 TETRAHYDROFURAN ANTIFUNGALS SCHERING CORP (US) 2003-05-14 EP disclosed
EP-0736030-B1 TETRAHYDROFURAN ANTIFUNGALS SCHERING CORP (US) 2001-08-29 EP disclosed
US-5714490-A 4-(4-(4-(-((5-(2,4-DIHALOPHENYL)--TETRAHYDRO-5-(1H-1,2,4-TRIAZOL-1-YLMETHYL)TETRAHYDROFUR-3-YL)METHOXY)PHENYL)-2,4-DIHYDRO-2-(MONO- OR DIHYDROXYALKYL)-3H-1,2,4-TRIAZOL-3-ONE; BROAD SPECTRUM; WATER SOLUBILITY; ASPERGILLUS; CANDIDA SCHERING CORPORATION (US) 1998-02-03 US disclosed
US-5710154-A Tetrahydrofuran antifungals SCHERING CORPORATION (US) 1998-01-20 US disclosed
US-5703236-A PROTECTING; REACTING WITH GRIGNARD REAGENT; REDUCTION; CYCLIZATION; DEPROTECTING SCHERING CORPORATION (US) 1997-12-30 US disclosed
US-5703079-A Tetrahydrofuran antifungals SCHERING CORPORATION (US) 1997-12-30 US disclosed
US-5698557-A Hydroxy-substituted antifungals SCHERING CORPORATION (US) 1997-12-16 US disclosed
EP-0773941-A1 TETRAHYDROFURAN ANTIFUNGALS SCHERING CORPORATION (US) 1997-05-21 EP disclosed
WO-1997000248-A1 HYDROXYALKYL-SUBSTITUTED TRIAZOLONES ANTIFUNGALS SCHERING CORPORATION (US) 1997-01-03 WO disclosed
EP-0736030-A1 TETRAHYDROFURAN ANTIFUNGALS SCHERING CORPORATION (US) 1996-10-09 EP disclosed
WO-1995017407-A1 TETRAHYDROFURAN ANTIFUNGALS SCHERING CORPORATION (US) 1995-06-29 WO disclosed