SCHEMBL7465845

SCHEMBL7465845

CCN(CC)C(=O)n1cnc(S(=O)(=O)CC2CCCCO2)n1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.38
KAT8 Q9H7Z6 2/20 0.36
KMT2A Q03164 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
AOC2 O75106 1/20 0.33
ALDH1A1 P00352 1/20 0.32
PER2 O15055 1/20 0.32
CRY1 Q16526 1/20 0.32
CRY2 Q49AN0 1/20 0.32
TTK P33981 1/20 0.32
CNR2 P34972 1/20 0.32

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
SCHEMBL9320879 0.84 DPP4 (0.42) DPP4KMT2ANPC1RAB9AALDH1A1
SCHEMBL9320225 0.83 DPP4 (0.41) DPP4KAT8KMT2ANPC1RAB9A
SCHEMBL9320901 0.83 DPP4 (0.41) DPP4KAT8KMT2ANPC1RAB9A
SCHEMBL9320192 0.82 DPP4 (0.42) DPP4KAT8KMT2ANPC1RAB9A
SCHEMBL9320911 0.81 DPP4 (0.43) DPP4KMT2AAOC2ALDH1A1
SCHEMBL7467032 0.77 ALDH1A1 (0.42) NPC1RAB9AALDH1A1
SCHEMBL10510171 0.73 DPP4 (0.39) DPP4KMT2AALDH1A1
SCHEMBL11561421 0.73 DPP4 (0.41) DPP4KMT2ANPC1ALDH1A1
SCHEMBL9542985 0.73 DPP4 (0.42) DPP4KMT2AALDH1A1
SCHEMBL10506679 0.72 DPP4 (0.37) DPP4

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-0929548-B1 SUBSTITUTED CARBAMOYL TRIAZOLES AND THEIR USE AS HERBICIDES BASF AG (DE) 2002-06-26 EP disclosed
US-6265352-B1 Substituted carbamoyl triazoles and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 2001-07-24 US disclosed