SCHEMBL1433193

SCHEMBL1433193

CN1CCCC[C@@H]1C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)NCc1ccc(N)nc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ NAMPT P43490 1/20 0.42
▸ MC4R P32245 1/20 0.42
▸ MC5R P33032 1/20 0.42
▸ MC3R P41968 1/20 0.42
▸ TSHR P16473 1/20 0.40
▸ MASP2 O00187 3/20 0.40
▸ EHMT2 Q96KQ7 1/20 0.39
▸ TLR2 O60603 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ PPIB P23284 1/20 0.38
▸ ITGB1 P05556 1/20 0.38
▸ ITGA4 P13612 1/20 0.38
▸ VHL P40337 1/20 0.38

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
SCHEMBL1432347 1.00 MEN1 (0.47) MEN1KMT2ANAMPTMC4RMC5R
SCHEMBL1431814 0.97 MEN1 (0.48) MEN1KMT2ANAMPTMC4RMC5R
SCHEMBL1432532 0.97 MEN1 (0.48) MEN1KMT2ANAMPTMC4RMC5R
SCHEMBL1432738 0.92 MEN1 (0.39) MEN1KMT2ANAMPTMASP2TLR2
SCHEMBL1432579 0.92 MEN1 (0.39) MEN1KMT2ANAMPTMASP2TLR2
SCHEMBL1432452 0.91 TLR2 (0.42) MEN1KMT2ANAMPTMASP2TLR2
SCHEMBL1432690 0.91 TLR2 (0.42) MEN1KMT2ANAMPTMASP2TLR2
SCHEMBL1431863 0.90 MEN1 (0.48) MEN1KMT2ANAMPTTSHRMASP2
SCHEMBL1432824 0.90 MASP2 (0.41) MEN1KMT2AMASP2PPIBITGB1
SCHEMBL1432180 0.89 DPP4 (0.40) MEN1KMT2AMASP2TLR2PPIB

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

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