SCHEMBL3372065

SCHEMBL3372065

CCOC(=O)C(CCC1CCCCC1)N1CCC[C@]1(C(=O)O)C(=O)[C@@H](N)CCCCNC(=O)C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.37
TSHR P16473 1/20 0.34
ALDH1A1 P00352 1/20 0.31
NAAA Q02083 1/20 0.30
DPP4 P27487 2/20 0.30
DPP8 Q6V1X1 2/20 0.30
EPHX1 P07099 1/20 0.30
DPP9 Q86TI2 1/20 0.30
DPP7 Q9UHL4 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
SCHEMBL3369565 0.84 DPP8 (0.38) DPP4DPP8DPP9DPP7
SCHEMBL6619629 0.84 DPP8 (0.38) DPP4DPP8DPP9DPP7
SCHEMBL3373796 0.82 KMT2A (0.35) DPP4DPP8DPP9DPP7
SCHEMBL5551891 0.79 DPP8 (0.36) DPP4DPP8DPP9DPP7
SCHEMBL3369358 0.75 METAP2 (0.42) METAP2TSHRALDH1A1EPHX1
SCHEMBL5351447 0.75 METAP2 (0.42) METAP2TSHRALDH1A1EPHX1
SCHEMBL3370863 0.73 DPP8 (0.37) DPP4DPP8EPHX1DPP9DPP7
SCHEMBL7275536 0.73 DPP8 (0.36) DPP4DPP8EPHX1DPP9DPP7
SCHEMBL3372067 0.73 PEPD (0.39) METAP2TSHRDPP4DPP8DPP9
SCHEMBL3369356 0.71 TSHR (0.41) METAP2TSHRALDH1A1EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1679303-B1 Process for preparing 1-alkoxycarbonyl-3-phenylpropyl derivative KANEKA CORP (JP) 2010-09-15 EP disclosed
EP-1679303-A1 Process for preparing 1-alkoxycarbonyl-3-phenylpropyl derivative Kaneka Corporation (JP) 2006-07-12 EP disclosed
EP-0903337-B1 PROCESS FOR THE PREPARATION OF 1-ALKOXYCARBONYL-3-PHENYLPROPYL DERIVATIVES KANEKA CORP (JP) 2006-04-12 EP disclosed
EP-0903337-A1 PROCESS FOR THE PREPARATION OF 1-ALKOXYCARBONYL-3-PHENYLPROPYL DERIVATIVES KANEKA CORPORATION (JP) 1999-03-24 EP disclosed