SCHEMBL31375006

SCHEMBL31375006

CC1(C)[C@@H]2[C@@H](C(=O)O)N(C(=O)[C@@H](N)C3CCOCC3)C[C@@H]21

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 12/20 0.33
CTSV O60911 1/20 0.32
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
ELANE P08246 1/20 0.32
CMA1 P23946 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
CTSF Q9UBX1 1/20 0.32
DPP8 Q6V1X1 3/20 0.31
DPP9 Q86TI2 2/20 0.31
DPP7 Q9UHL4 2/20 0.31
FAP Q12884 1/20 0.31

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
Hydrochloric Acid SCHEMBL31376782 0.99 DPP4 (0.33) DPP4CTSVCTSLCTSBELANE
SCHEMBL25281235 0.91 DPP4 (0.36) DPP4CTSVCTSLCTSBELANE
SCHEMBL24691272 0.91 DPP4 (0.36) DPP4CTSVCTSLCTSBELANE
SCHEMBL24961034 0.91 DPP4 (0.36) DPP4CTSVCTSLCTSBELANE
Hydrochloric Acid SCHEMBL30002339 0.90 DPP4 (0.36) DPP4CTSVCTSLCTSBELANE
SCHEMBL31374981 0.88 DPP4 (0.41) DPP4DPP8DPP9DPP7FAP
SCHEMBL30457519 0.88 DPP4 (0.38) DPP4CTSVCTSLCTSBELANE
Hydrochloric Acid SCHEMBL31376809 0.87 DPP4 (0.40) DPP4DPP8DPP9DPP7FAP
Trifluoroacetic Acid SCHEMBL25270519 0.82 DPP4 (0.36) DPP4CTSVCTSLCTSBELANE
Trifluoroacetic Acid SCHEMBL32664813 0.81 DPP4 (0.41) DPP4DPP8DPP9DPP7FAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119306790-A Amide derivative, composition and use thereof 深圳市塔吉瑞生物医药有限公司 2025-01-14 CN disclosed