SCHEMBL6973410

SCHEMBL6973410

CC(C)c1nc(CCOC(N)=O)n(Cc2ccccc2)c1Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
TSHR P16473 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
POLB P06746 1/20 0.35
ENPP2 Q13822 2/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL6972595 0.94 LMNA (0.48) LMNATLR7
SCHEMBL6962251 0.89 TDP1 (0.38) LMNATSHRKDM4EALDH1A1GAA
SCHEMBL6962178 0.81 LMNA (0.40) LMNAMAPTTDP1TLR7SMN1; SMN2
SCHEMBL6968903 0.79 MEN1 (0.43) LMNATSHRALDH1A1MAPTTDP1
SCHEMBL6972473 0.78 LMNA (0.36) LMNATSHRKDM4EALDH1A1GLA
SCHEMBL6967887 0.78 LMNA (0.35) LMNATSHRKDM4EALDH1A1GLA
SCHEMBL6968774 0.77 PIM1 (0.35) LMNATLR7ENPP2
SCHEMBL27534463 0.76 GNRHR (0.36) LMNATSHRKDM4EALDH1A1GLA
SCHEMBL27413615 0.75 KDM4E (0.33) LMNAKDM4EALDH1A1TLR7ENPP2
SCHEMBL6974469 0.75 TLR7 (0.36) LMNAKDM4EALDH1A1TLR7ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0786455-B1 IMIDAZOLE DERIVATIVE SHIONOGI & CO (JP) 2003-12-03 EP disclosed
CN-1093535-C Imidazole derivative SHIONOGI & CO (JP) 2002-10-30 CN disclosed
US-6147097-A METHOD FOR TREATING AIDS SHIONOGI & CO., LTD. (JP) 2000-11-14 US disclosed
US-5910506-A IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC SHIONOGI & CO., LTD. (JP) 1999-06-08 US disclosed
CN-1158609-A Imidazole derivative SHIONOGI & CO (JP) 1997-09-03 CN disclosed
EP-0786455-A1 IMIDAZOLE DERIVATIVE SHIONOGI & CO., LTD. (JP) 1997-07-30 EP disclosed