SCHEMBL1431863

SCHEMBL1431863

CC(C)N1CCCC[C@@H]1C(=O)N[C@@H](Cc1ccc(F)cc1)C(=O)NCc1ccc(N)nc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ NAMPT P43490 1/20 0.41
▸ MASP2 O00187 3/20 0.40
▸ TSHR P16473 1/20 0.39
▸ EHMT2 Q96KQ7 1/20 0.38
▸ PPIB P23284 2/20 0.37
▸ ITGB1 P05556 1/20 0.37
▸ ITGA4 P13612 1/20 0.37
▸ VHL P40337 1/20 0.37

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
SCHEMBL1432069 0.97 MEN1 (0.49) MEN1KMT2ANAMPTMASP2PPIB
SCHEMBL1432054 0.92 MEN1 (0.40) MEN1KMT2ANAMPTMASP2PPIB
SCHEMBL1431881 0.90 MASP2 (0.41) MEN1KMT2AMASP2PPIBITGB1
SCHEMBL1432347 0.90 MEN1 (0.47) MEN1KMT2ANAMPTMASP2TSHR
SCHEMBL1433193 0.90 MEN1 (0.47) MEN1KMT2ANAMPTMASP2TSHR
SCHEMBL1431634 0.89 MEN1 (0.41) MEN1KMT2AMASP2PPIB
SCHEMBL1432518 0.89 MEN1 (0.41) MEN1KMT2AMASP2PPIB
SCHEMBL1432532 0.87 MEN1 (0.48) MEN1KMT2ANAMPTMASP2EHMT2
SCHEMBL1431814 0.87 MEN1 (0.48) MEN1KMT2ANAMPTMASP2EHMT2
SCHEMBL1432208 0.86 TACR1 (0.44) MEN1KMT2AMASP2PPIB

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 disclosed
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