SCHEMBL9765038

SCHEMBL9765038

NC(=O)CCCCCCCC1(c2ccccc2)CCCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.50
LMNA P02545 5/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
EPHX2 P34913 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
SLC6A4 P31645 3/20 0.45
HSD17B10 Q99714 1/20 0.43
AKR1C1 Q04828 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
MAPK1 P28482 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
SLC6A2 P23975 2/20 0.41
SLC6A3 Q01959 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAOA P21397 1/20 0.41

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
SCHEMBL7213217 0.87 EPHX2 (0.53) DPP4LMNAMEN1KMT2AEPHX2
SCHEMBL433785 0.81 EPHX2 (0.53) DPP4LMNAMEN1KMT2AEPHX2
SCHEMBL4866308 0.78 DPP4 (0.58) DPP4LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL8485828 0.78 DPP4 (0.53) DPP4LMNAMEN1KMT2AEPHX2
SCHEMBL17761202 0.77 DPP4 (0.56) DPP4LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL436643 0.77 DPP4 (0.52) DPP4LMNAMEN1KMT2AEPHX2
SCHEMBL15795307 0.77 SLC6A4 (0.54) DPP4LMNAMEN1KMT2AEPHX2
SCHEMBL2439795 0.76 LMNA (0.44) DPP4LMNAMEN1KMT2AEPHX2
SCHEMBL10590819 0.76 SLC6A4 (0.57) DPP4SLC6A4SLC6A2SLC6A3
SCHEMBL18440285 0.75 EPHX2 (0.52) DPP4LMNAMEN1KMT2AEPHX2

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
US-4994465-A Antihyperlipidemic and antiatherosclerotic trisubstituted urea compounds WARNER-LAMBERT COMPANY (US) 1991-02-19 US disclosed
EP-0384320-A1 Antihyperlipidemic and anti-atherosclerotic trisubstituted urea compounds WARNER-LAMBERT COMPANY (US) 1990-08-29 EP disclosed