SCHEMBL29635014

SCHEMBL29635014

N[C@@H](Cc1ccccc1)C(=O)C1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALPI P09923 1/20 0.56
PKM P14618 1/20 0.56
PTGS1 P23219 1/20 0.56
XIAP P98170 1/20 0.56
SLC7A5 Q01650 1/20 0.56
DPP4 P27487 4/20 0.51
DPP8 Q6V1X1 3/20 0.51
DPP9 Q86TI2 3/20 0.51
DPP7 Q9UHL4 3/20 0.51
FAP Q12884 2/20 0.49
SLC15A1 P46059 1/20 0.49
HDAC8 Q9BY41 2/20 0.48
LTA4H P09960 1/20 0.46
ANPEP P15144 2/20 0.46
ERAP2 Q6P179 2/20 0.46
CTSC P53634 1/20 0.46
ACE P12821 1/20 0.45
SLC1A3 P43003 1/20 0.45
SLC1A2 P43004 1/20 0.45
SLC1A1 P43005 1/20 0.45

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
SCHEMBL22674759 1.00 ALPI (0.56) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL22674760 1.00 ALPI (0.56) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL21297195 1.00 ALPI (0.56) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL31606459 0.86 SLC7A5 (0.56) SLC7A5DPP4HDAC8
SCHEMBL30553747 0.83 EPHX1 (0.52) DPP4CTSCSLC1A3SLC1A2SLC1A1
SCHEMBL10305183 0.83 CYP19A1 (0.44) DPP4DPP8DPP9DPP7FAP
Dl-Phenylalanine SCHEMBL27841330 0.83 SLC7A5 (0.69) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL11445439 0.80 NPC1 (0.47) DPP4DPP8DPP9FAPHDAC8
Dl-Phenylalanine SCHEMBL25221060 0.79 SLC7A5 (0.88) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL5391655 0.78 ALDH1A1 (0.43) ALDH1A1CYP2C19

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-3997104-A1 COMPOUNDS COMPRISING A FIBROBLAST ACTIVATION PROTEIN LIGAND AND USE THEREOF 3B Pharmaceuticals GmbH (DE) 2022-05-18 EP disclosed