SCHEMBL8029698

SCHEMBL8029698

CCC(C)Oc1cccc2cccnc12

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 8/20 0.64
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
POLB P06746 2/20 0.57
MAPT P10636 4/20 0.49
KDM4E B2RXH2 4/20 0.49
LMNA P02545 3/20 0.49
RAB9A P51151 5/20 0.49
NPC1 O15118 4/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
GAA P10253 2/20 0.49
ALDH1A1 P00352 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL5884169 0.83 MCHR1 (0.67) MCHR1MEN1KMT2APOLBMAPT
SCHEMBL1101672 0.83 MEN1 (0.72) MCHR1MEN1KMT2APOLBMAPT
SCHEMBL31362204 0.83 MEN1 (0.52) MCHR1MEN1KMT2APOLBMAPT
Hydrochloric Acid SCHEMBL9051799 0.81 MEN1 (0.70) MCHR1MEN1KMT2APOLBMAPT
SCHEMBL21206948 0.81 MEN1 (0.51) MCHR1MEN1KMT2APOLBMAPT
SCHEMBL9827803 0.80 MEN1 (0.56) MCHR1MEN1KMT2APOLBMAPT
SCHEMBL6221828 0.79 MEN1 (0.49) MCHR1MEN1KMT2APOLBMAPT
SCHEMBL5883697 0.78 MCHR1 (1.00) MCHR1
SCHEMBL5884208 0.78 MCHR1 (1.00) MCHR1
SCHEMBL5883758 0.78 MCHR1 (1.00) MCHR1

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
WO-2011137492-A1 POLYMER-BASED ORGANIC ELECTROLUMINESCENT DEVICE COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2011-11-10 WO disclosed
EP-0975586-A2 OXIME COMPOUNDS, THEIR USE, AND INTERMEDIATES FOR THEIR PRODUCTION Sumitomo Chemical Company, Limited (JP) 2000-02-02 EP disclosed
WO-1998045254-A2 OXIME COMPOUNDS, THEIR USE, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-10-15 WO disclosed