SCHEMBL9268778

SCHEMBL9268778

COOC(=O)c1c(OC)cc2c(OC)c3cccc(OC)c3c(OC)c2c1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.36
ALDH1A1 P00352 4/20 0.36
HPGD P15428 3/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 6/20 0.36
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GAA P10253 3/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
POLB P06746 2/20 0.36
HTT P42858 2/20 0.36
EDNRA P25101 1/20 0.36
TSHR P16473 1/20 0.36
RECQL P46063 1/20 0.36
MCL1 Q07820 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 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
SCHEMBL8952362 0.89 LMNA (0.47) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL8976115 0.77 CYP3A4 (0.43) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL8952310 0.76 MAPT (0.47) ALDH1A1MAPTLMNASMN1; SMN2GAA
SCHEMBL12627519 0.73 ALDH1A1 (0.54) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL8952390 0.72 CYP3A4 (0.46) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL8976409 0.72 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL8976444 0.71 PRKCZ (0.45) HSD17B10SMN1; SMN2KMT2AMEN1POLB
SCHEMBL8976463 0.69 KDM4E (0.40) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL9628374 0.67 HTT (0.43) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL8952412 0.65 MAPT (0.41) KDM4EHPGDMAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5424421-A Synthesis of carminic acid and principal intermediates EUROPEAN COLOUR PLC (GB) 1995-06-13 US claimed