SCHEMBL8803115

SCHEMBL8803115

Cc1cccc(CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)c1NC(=O)NC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.65
MAOA P21397 4/20 0.65
DCUN1D1 Q96GG9 3/20 0.54
ACHE P22303 2/20 0.53
KMT2A Q03164 2/20 0.51
DRD2 P14416 1/20 0.51
DRD4 P21917 1/20 0.51
DRD3 P35462 1/20 0.51
LMNA P02545 1/20 0.51
UBE2M P61081 2/20 0.49
POLB P06746 2/20 0.49
ALDH1A1 P00352 1/20 0.49
CCR3 P51677 2/20 0.49
BCHE P06276 1/20 0.49
KDM4E B2RXH2 1/20 0.49
HSD17B10 Q99714 1/20 0.49
TSHR P16473 1/20 0.48
SIGMAR1 Q99720 1/20 0.48

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
SCHEMBL8803545 0.89 MAOB (0.62) MAOBMAOADCUN1D1ACHEKMT2A
SCHEMBL8805057 0.88 MAOB (0.69) MAOBMAOADCUN1D1ACHEKMT2A
SCHEMBL8803219 0.85 MAOB (0.63) MAOBMAOADCUN1D1ACHEKMT2A
Hydrochloric Acid SCHEMBL8804469 0.84 MAOB (0.62) MAOBMAOADCUN1D1ACHEKMT2A
SCHEMBL8804925 0.84 MAOB (0.71) MAOBMAOADCUN1D1ACHEKMT2A
SCHEMBL8804219 0.83 MAOB (0.65) MAOBMAOADCUN1D1ACHEKMT2A
SCHEMBL8803034 0.83 MAOB (0.61) MAOBMAOAACHEKMT2ADRD2
SCHEMBL8804647 0.82 MAOB (0.64) MAOBMAOADCUN1D1ACHEKMT2A
SCHEMBL8805081 0.82 MAOB (0.64) MAOBMAOADCUN1D1ACHEKMT2A
SCHEMBL8804959 0.82 MAOB (0.59) MAOBMAOADCUN1D1ACHEKMT2A

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