SCHEMBL8089336

SCHEMBL8089336

CCSc1n[c]cc(C)n1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP1A2 P05177 1/20 0.38
HSP90AA1 P07900 1/20 0.37
GAA P10253 1/20 0.33
MAOB P27338 1/20 0.33
POLB P06746 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
ALOX15 P16050 1/20 0.32
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
ALDH1A1 P00352 2/20 0.30
ABCB1 P08183 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL1679882 0.77
SCHEMBL266824 0.72 LMNA (0.70) LMNAKDM4ECYP1A2HSP90AA1GAA
SCHEMBL9784711 0.71 POLB (0.31) POLBAPOBEC3G
SCHEMBL18001725 0.69 LMNA (0.54) LMNAKDM4ECYP1A2HSP90AA1GAA
SCHEMBL52748 0.66
SCHEMBL5610499 0.65
SCHEMBL8363955 0.65 ALOX15 (0.66) LMNAKDM4EPOLBALOX15ALDH1A1
SCHEMBL12039946 0.64 HSP90AA1 (0.54) LMNAKDM4ECYP1A2HSP90AA1GAA
SCHEMBL11347192 0.64 LMNA (0.52) LMNAKDM4ECYP1A2HSP90AA1GAA
SCHEMBL11272018 0.64 LMNA (0.52) LMNAKDM4ECYP1A2HSP90AA1GAA

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
US-6043242-A TREATING A MAMMAL AFFLICTED WITH A DISEASE BASED ON HELICOBACTER BACTERIA BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2000-03-28 US disclosed
EP-0946559-A2 IMIDAZOPYRIDAZINES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1999-10-06 EP disclosed
WO-1998028299-A2 IMIDAZOPYRIDAZINES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1998-07-02 WO disclosed