SCHEMBL8804245

SCHEMBL8804245

CC(C)C(N)c1ccc(N2CCCC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
MAPT P10636 4/20 0.47
KDM4E B2RXH2 3/20 0.47
NPSR1 Q6W5P4 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MEN1 O00255 2/20 0.47
GAA P10253 2/20 0.47
KMT2A Q03164 2/20 0.47
NPC1 O15118 1/20 0.47
USP2 O75604 1/20 0.47
TP53 P04637 1/20 0.47
POLB P06746 1/20 0.47
THRB P10828 1/20 0.47
ALOX15 P16050 1/20 0.47
HTT P42858 1/20 0.47
RECQL P46063 1/20 0.47
RAB9A P51151 1/20 0.47
HSD17B10 Q99714 1/20 0.47
L3MBTL3 Q96JM7 1/20 0.41
TRIM24 O15164 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
SCHEMBL1239116 0.85 ALDH1A1 (0.49) ALDH1A1MAPTKDM4ENPSR1L3MBTL1
SCHEMBL19601809 0.84 ALDH1A1 (0.55) ALDH1A1MAPTKDM4ENPSR1L3MBTL1
SCHEMBL21388651 0.84 ALDH1A1 (0.55) ALDH1A1MAPTKDM4ENPSR1L3MBTL1
SCHEMBL14831525 0.84 ALDH1A1 (0.55) ALDH1A1MAPTKDM4ENPSR1L3MBTL1
Hydrochloric Acid SCHEMBL21378501 0.82 ALDH1A1 (0.59) ALDH1A1MAPTKDM4ENPSR1L3MBTL1
Hydrochloric Acid SCHEMBL21378503 0.82 ALDH1A1 (0.59) ALDH1A1MAPTKDM4ENPSR1L3MBTL1
SCHEMBL10404832 0.79 ALDH1A1 (0.49) ALDH1A1MAPTKDM4ENPSR1L3MBTL1
SCHEMBL277165 0.79 ALDH1A1 (0.54) ALDH1A1MAPTKDM4ENPSR1L3MBTL1
SCHEMBL847809 0.78 ALDH1A1 (0.57) ALDH1A1MAPTKDM4ENPSR1L3MBTL1
SCHEMBL18118180 0.78 ALDH1A1 (0.57) ALDH1A1MAPTKDM4ENPSR1L3MBTL1

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
EP-0625507-B1 Urea derivatives and their use as acat inhibitors NISSHIN FLOUR MILLING CO (JP) 1997-07-23 EP disclosed
US-5621010-A ANTIHYPERCHOLESTEROLEMIA AND ANTIATHEROSCLEROSIS NISSHIN FLOUR MILLING CO., LTD. (JP) 1997-04-15 US disclosed
EP-0625507-A2 Urea derivatives and their use as acat inhibitors NISSHIN FLOUR MILLING CO., LTD. (JP) 1994-11-23 EP disclosed