SCHEMBL7899891

SCHEMBL7899891

NC(=O)CCC(NC(=O)C1CCCN1C(=O)C1CCCN1C(=O)C1CCCN1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GRB2 P62993 1/20 0.41
▸ DPP4 P27487 3/20 0.40
▸ DPP8 Q6V1X1 2/20 0.40
▸ FAP Q12884 1/20 0.40
▸ DPP9 Q86TI2 1/20 0.40
▸ DPP7 Q9UHL4 1/20 0.40
▸ PLG P00747 2/20 0.39
▸ PLAT P00750 2/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CAPN1 P07384 2/20 0.37
▸ CTSB P07858 1/20 0.36
▸ OPRK1 P41145 1/20 0.36
▸ ITGB1 P05556 1/20 0.35
▸ ITGA4 P13612 1/20 0.35
▸ VHL P40337 1/20 0.35

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
SCHEMBL7899895 1.00 GRB2 (0.41) GRB2DPP4DPP8FAPDPP9
Hydrochloric Acid SCHEMBL7899918 0.99 GRB2 (0.41) GRB2DPP4DPP8FAPDPP9
Hydrochloric Acid SCHEMBL7899915 0.99 GRB2 (0.41) GRB2DPP4DPP8FAPDPP9
SCHEMBL29706282 0.98 DPP4 (0.42) GRB2DPP4DPP8FAPDPP9
SCHEMBL29591671 0.94 GRB2 (0.44) GRB2DPP4DPP8FAPDPP9
SCHEMBL29630697 0.94 GRB2 (0.44) GRB2DPP4DPP8FAPDPP9
SCHEMBL30574235 0.92 DPP4 (0.42) GRB2DPP4DPP8FAPDPP9
SCHEMBL29438447 0.89 DPP4 (0.43) DPP4DPP8FAPDPP9DPP7
SCHEMBL31696260 0.88 GRB2 (0.44) GRB2OPRK1
SCHEMBL30937369 0.87 REN (0.43) GRB2

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
US-6180114-B1 A DEVICE-FREE METHOD BY WHICH LIGANDS, SUCH AS DRUGS, CAN BE RELEASED INTO THE BODY, PARTICULARLY IN CONTINUOUS MANNER THROUGH ASSOCIATION WITH HIGH AXIAL RATIO MICROSTRUCTURES (HARMS) UNIVERSITY OF WASHINGTON 2001-01-30 — — US disclosed
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