SCHEMBL1432142

SCHEMBL1432142

CC(C(=O)NC[C@H](C(=O)NCc1ccc(N)nc1)c1cc(F)cc(F)c1)N1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ EHMT2 Q96KQ7 1/20 0.46
▸ SCN5A Q14524 2/20 0.39
▸ SCN9A Q15858 2/20 0.39
▸ NAMPT P43490 2/20 0.39
▸ CCR2 P41597 3/20 0.38
▸ TLR2 O60603 1/20 0.38
▸ MASP2 O00187 3/20 0.37
▸ EIF2AK3 Q9NZJ5 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ TRPV1 Q8NER1 1/20 0.35
▸ CPA1 P15085 2/20 0.35
▸ CPB2 Q96IY4 2/20 0.35
▸ CHRNB2 P17787 1/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ CHRNB4 P30926 1/20 0.34
▸ CHRNA3 P32297 1/20 0.34
▸ CHRNA4 P43681 1/20 0.34
▸ SLC6A3 Q01959 1/20 0.34
▸ CPB1 P15086 1/20 0.34

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
SCHEMBL1432219 0.92 EHMT2 (0.51) EHMT2NAMPTCCR2MASP2
SCHEMBL1431927 0.92 EHMT2 (0.51) EHMT2NAMPTCCR2MASP2
SCHEMBL1432565 0.90 EHMT2 (0.45) EHMT2NAMPTCCR2TLR2MASP2
SCHEMBL1431965 0.89 EHMT2 (0.43) EHMT2NAMPTCCR2TLR2MASP2
SCHEMBL1432580 0.86 CCR2 (0.45) EHMT2CCR2MASP2TRPV1
SCHEMBL1432256 0.86 CCR2 (0.45) EHMT2CCR2MASP2TRPV1
SCHEMBL1432418 0.85 CHRNA1 (0.41) EHMT2MASP2TRPV1CHRNB2SLC6A2
SCHEMBL1433112 0.85 KCNQ2 (0.42) EHMT2SCN5ASCN9ACCR2TRPV1
SCHEMBL1432137 0.82 EHMT2 (0.44) EHMT2SCN5ASCN9ANAMPTTLR2
SCHEMBL1432213 0.78 EHMT2 (0.47) EHMT2NAMPTMASP2

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 disclosed
WO-2009133348-A1 AMINOPYRIDINE DERIVATIVES VANTIA LIMITED (GB) 2009-11-05 — — WO disclosed
Send feedback