SCHEMBL160989

SCHEMBL160989

NC(=O)c1ccc(S(=O)(=O)N2CCNCC2)cc1

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.70
MAPT P10636 3/20 0.61
IKBKB O14920 1/20 0.60
CHUK O15111 1/20 0.60
F13A1 P00488 1/20 0.55
TGM2 P21980 1/20 0.55
TGM1 P22735 1/20 0.55
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
PKM P14618 1/20 0.51
GFER P55789 1/20 0.50
GAA P10253 1/20 0.49
LMNA P02545 1/20 0.49
CA2 P00918 1/20 0.49
MAPK1 P28482 1/20 0.48
OPRD1 P41143 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL29098532 0.85 ALDH1A1 (0.72) ALDH1A1MAPTF13A1TGM2TGM1
SCHEMBL2744764 0.85 ALDH1A1 (0.70) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL3847472 0.84 ALDH1A1 (0.97) ALDH1A1MAPTIKBKBCHUKF13A1
SCHEMBL2744997 0.83 USP2 (0.69) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL2744785 0.81 L3MBTL1 (0.70) ALDH1A1NPC1SMN1; SMN2GAALMNA
SCHEMBL22399269 0.80 NAMPT (0.56) IKBKBCHUK
SCHEMBL11510345 0.80 MAPT (0.69) ALDH1A1MAPTF13A1TGM2TGM1
SCHEMBL29764424 0.80 MAPT (0.69) ALDH1A1MAPTIKBKBCHUKF13A1
SCHEMBL14057769 0.79 KMT2A (0.55) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL4212318 0.78 LMNA (0.71) ALDH1A1MAPTNPC1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103384668-B compounds and compositions for inhibition of NAMPT 福马TM有限责任公司 2017-05-31 CN claimed
EP-2611804-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT Forma TM, LLC. (US) 2013-07-10 EP disclosed
WO-2012031197-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT FORMA THERAPEUTICS, INC. (US) 2012-03-08 WO disclosed