SCHEMBL8142168

SCHEMBL8142168

CCCCCC(CC(=O)Nc1cc(C(=O)NC)ccc1C(C)(C)C)c1ccc(C(=O)O)cc1OC

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 3/20 0.41
EPHX2 P34913 1/20 0.41
CREBBP Q92793 1/20 0.41
SMPD1 P17405 5/20 0.37
RARA P10276 1/20 0.36
RARB P10826 1/20 0.36
RARG P13631 1/20 0.36
LTB4R Q15722 2/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
TSHR P16473 1/20 0.35
PLA2G4B P0C869 1/20 0.35
HDAC3 O15379 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL8142215 0.92 KMT2A (0.39) NR1H4EPHX2SMPD1HDAC3HDAC2
SCHEMBL8205258 0.92 KMT2A (0.39) NR1H4EPHX2SMPD1HDAC3HDAC2
SCHEMBL8148216 0.92 LPAR1 (0.41) TSHRHDAC3HDAC2HDAC1HDAC8
SCHEMBL8149905 0.92 NR1H4 (0.35) NR1H4EPHX2CREBBPSMPD1HDAC3
SCHEMBL8134186 0.91 NR1H4 (0.39) NR1H4EPHX2CREBBPSMPD1RARA
SCHEMBL8134646 0.91 LPAR1 (0.40) TSHRHDAC1HDAC8HDAC6
SCHEMBL8128937 0.91 KMT2A (0.40) NR1H4EPHX2SMPD1RARARARB
SCHEMBL8129477 0.91 NR1H4 (0.38) NR1H4EPHX2RARARARBRARG
SCHEMBL8142540 0.90 NR1H4 (0.37) NR1H4EPHX2SMPD1HDAC2HDAC1
SCHEMBL8135122 0.90 HDAC1 (0.40) NR1H4CREBBPSMPD1TSHRHDAC1

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