SCHEMBL26528469

SCHEMBL26528469

CCCN(CCC)CCCC[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 2/20 0.45
▸ DPP8 Q6V1X1 2/20 0.45
▸ DPP9 Q86TI2 2/20 0.45
▸ DPP7 Q9UHL4 2/20 0.45
▸ NOD1 Q9Y239 9/20 0.40
▸ MME P08473 2/20 0.40
▸ GNPAT O15228 1/20 0.36
▸ FAP Q12884 1/20 0.36
▸ SLC6A5 Q9Y345 1/20 0.36
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ FOLH1 Q04609 1/20 0.35
▸ DRD2 P14416 1/20 0.34
▸ DRD4 P21917 1/20 0.34
▸ DRD3 P35462 1/20 0.34
▸ CPB2 Q96IY4 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
SCHEMBL24642917 0.95 DPP4 (0.48) DPP4DPP8DPP9DPP7NOD1
SCHEMBL24642680 0.90 DPP4 (0.43) DPP4DPP8DPP9DPP7NOD1
SCHEMBL24642916 0.85 DPP4 (0.41) DPP4DPP8DPP9DPP7NOD1
SCHEMBL29476460 0.84 DPP8 (0.60) DPP4DPP8DPP9DPP7NOD1
SCHEMBL31720380 0.83 DPP4 (0.42) DPP4DPP8DPP9DPP7NOD1
SCHEMBL26496891 0.83 DPP4 (0.40) DPP4DPP8DPP9DPP7FAP
SCHEMBL31326452 0.82 DPP4 (0.40) DPP4DPP8DPP9DPP7NOD1
SCHEMBL8492399 0.81 DPP4 (0.51) DPP4DPP8DPP9DPP7NOD1
SCHEMBL31720381 0.81 DPP4 (0.45) DPP4DPP8DPP9DPP7NOD1
SCHEMBL1711313 0.80 FOLH1 (0.54) DPP4DPP8DPP9DPP7NOD1

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
EP-4257154-A1 BIOACTIVE SUBSTANCE CONJUGATE, PREPARATION METHOD THEREFOR AND USE THEREOF Medilink Therapeutics (Suzhou) Co., Ltd. (CN) 2023-10-11 — — EP disclosed
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