SCHEMBL1432174

SCHEMBL1432174

CCCN1CCC[C@@H]1C(=O)N[C@@H](Cc1ccc(F)c(F)c1)C(=O)NCc1ccc(N)nc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ XIAP P98170 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ MASP2 O00187 2/20 0.37
▸ KLKB1 P03952 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ F2 P00734 2/20 0.36
▸ MET P08581 1/20 0.36
▸ KCNK3 O14649 1/20 0.36
▸ PPIB P23284 1/20 0.36
▸ PDPK1 O15530 1/20 0.36
▸ POLB P06746 1/20 0.36

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
SCHEMBL1432074 1.00 DPP4 (0.38) DPP4KCNH2MEN1KMT2AXIAP
SCHEMBL1431769 0.94 DPP4 (0.39) DPP4KCNH2MEN1KMT2AXIAP
SCHEMBL1432630 0.94 DPP4 (0.39) DPP4KCNH2MEN1KMT2AXIAP
SCHEMBL1432146 0.92 MEN1 (0.46) MEN1KMT2AALDH1A1LMNAMASP2
SCHEMBL1432209 0.91 F2 (0.42) DPP4KCNH2MEN1KMT2AXIAP
SCHEMBL1432780 0.91 F2 (0.42) DPP4KCNH2MEN1KMT2AXIAP
SCHEMBL1431638 0.90 DPP4 (0.40) DPP4KCNH2MEN1KMT2AXIAP
SCHEMBL1432180 0.90 DPP4 (0.40) DPP4KCNH2MEN1KMT2AXIAP
SCHEMBL3150073 0.90 MASP2 (0.40) DPP4KCNH2MEN1KMT2AXIAP
Hydrochloric Acid SCHEMBL1432515 0.90 DPP4 (0.40) DPP4KCNH2MEN1KMT2AXIAP

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-2300428-A1 AMINOPYRIDINE DERIVATIVES Vantia Limited (GB) 2011-03-30 — — EP claimed
Send feedback