SCHEMBL2430899

SCHEMBL2430899

CC(C)(C)[C@@H]1C(N)CCCN1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 9/20 0.40
HSD17B10 Q99714 2/20 0.38
LMNA P02545 2/20 0.38
CYP2C19 P33261 1/20 0.38
FAP Q12884 6/20 0.37
DPP8 Q6V1X1 5/20 0.37
DPP9 Q86TI2 5/20 0.37
DPP7 Q9UHL4 5/20 0.37
RIPK1 Q13546 1/20 0.37
PITRM1 Q5JRX3 1/20 0.36
PREP P48147 3/20 0.33
POLB P06746 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL14480015 1.00 DPP4 (0.40) DPP4HSD17B10LMNACYP2C19FAP
SCHEMBL1920132 1.00 DPP4 (0.40) DPP4HSD17B10LMNACYP2C19FAP
SCHEMBL5002190 1.00 DPP4 (0.40) DPP4HSD17B10LMNACYP2C19FAP
SCHEMBL2330612 0.95 HPGD (0.38) DPP4HSD17B10LMNACYP2C19FAP
SCHEMBL16600622 0.89 DPP4 (0.34) DPP4HSD17B10LMNACYP2C19RIPK1
SCHEMBL322779 0.89 DPP4 (0.34) DPP4HSD17B10LMNACYP2C19RIPK1
SCHEMBL4523902 0.89 DPP4 (0.34) DPP4HSD17B10LMNACYP2C19RIPK1
SCHEMBL322778 0.89 DPP4 (0.34) DPP4HSD17B10LMNACYP2C19RIPK1
Hydrochloric Acid SCHEMBL7517295 0.87 DPP4 (0.33) DPP4LMNARIPK1
SCHEMBL29392820 0.85 DPP4 (0.40) DPP4HSD17B10LMNACYP2C19FAP

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-2762476-A1 1,2,4-TRIAZINE-6-CARBOXAMIDE DERIVATIVE Taiho Pharmaceutical Co., Ltd. (JP) 2014-08-06 EP disclosed
WO-2012061415-A1 OXYPYRIMIDINES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 WO disclosed
EP-2366698-A1 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor Galapagos SAS (FR) 2011-09-21 EP disclosed