SCHEMBL8134646

SCHEMBL8134646

CCCCCCC(CC(=O)Nc1cc(C(=O)NC)ccc1C(C)(C)C)c1ccc(OC)cc1OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 1/20 0.40
MAPK1 P28482 2/20 0.38
ALDH1A1 P00352 2/20 0.37
MAPT P10636 3/20 0.37
TSHR P16473 2/20 0.37
PLK1 P53350 1/20 0.36
PLK3 Q9H4B4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX15 P16050 1/20 0.36
ACAT1 P24752 1/20 0.36
SOAT1 P35610 1/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
HDAC1 Q13547 1/20 0.35

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
SCHEMBL8148216 0.99 LPAR1 (0.41) LPAR1MAPK1ALDH1A1MAPTTSHR
SCHEMBL8140040 0.97 LPAR1 (0.41) LPAR1MAPK1ALDH1A1MAPTTSHR
SCHEMBL8135122 0.94 HDAC1 (0.40) LPAR1MAPK1MAPTTSHRPLK1
SCHEMBL8148224 0.94 ALDH1A1 (0.38) LPAR1MAPK1ALDH1A1MAPTHDAC1
SCHEMBL8131422 0.94 LPAR1 (0.39) LPAR1MAPK1ALDH1A1MAPTTSHR
SCHEMBL8120317 0.93 GAA (0.39) LPAR1MAPK1ALDH1A1MAPTTSHR
SCHEMBL8119974 0.93 LPAR1 (0.39) LPAR1MAPK1ALDH1A1MAPTTSHR
SCHEMBL8120544 0.93 KMT2A (0.40) LPAR1MAPK1ALDH1A1MAPTTSHR
SCHEMBL8133459 0.92 MAPK1 (0.38) LPAR1MAPK1MAPTPLK1MMP1
SCHEMBL8136536 0.92 LPAR1 (0.39) LPAR1MAPK1ALDH1A1MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0763524-B1 Urea and amide derivatives having ACAT inhibitory activity, their preparation and their therapeutic and prophylactic use SANKYO CO (JP) 2000-08-23 EP disclosed
US-6040339-A TREATMENT AND PROPHYLAXIS OF HYPERCHOLESTEREMIA OR ARTERIOSCLEROSIS IN A MAMMAL SANKYO COMPANY, LIMITED (JP) 2000-03-21 US disclosed
US-5880147-A Amide derivatives having ACAT inhibitory activity, their preparation and their therapeutic and prohylactic use SANKYO COMPANY, LIMITED (JP) 1999-03-09 US disclosed
EP-0763524-A1 Urea and amide derivatives having ACAT inhibitory activity, their preparation and their therapeutic and prophylactic use SANKYO COMPANY LIMITED (JP) 1997-03-19 EP disclosed