SCHEMBL10673449

SCHEMBL10673449

CCOC(=O)/C(=C\c1cc(OC)c(O)c(OC)c1)C(C)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.51
LMNA P02545 5/20 0.51
POLB P06746 3/20 0.51
GLO1 Q04760 2/20 0.50
GAA P10253 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
MEN1 O00255 8/20 0.49
KMT2A Q03164 8/20 0.49
PLIN1 O60240 1/20 0.49
PLIN5 Q00G26 1/20 0.49
ABHD5 Q8WTS1 1/20 0.49
ALDH1A1 P00352 5/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 2/20 0.47
HSP90AA1 P07900 1/20 0.47
NPSR1 Q6W5P4 3/20 0.47
PKM P14618 2/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ALOX5 P09917 1/20 0.47

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
SCHEMBL2213830 1.00 MAPT (0.51) MAPTLMNAPOLBGLO1GAA
SCHEMBL12211765 1.00 MAPT (0.51) MAPTLMNAPOLBGLO1GAA
SCHEMBL2897877 0.93 KMT2A (0.57) MAPTLMNAPOLBGAAMEN1
SCHEMBL5011134 0.89 ALOX5 (0.58) MAPTLMNAPOLBGLO1GAA
SCHEMBL9125332 0.89 MEN1 (0.53) MAPTLMNAPOLBMEN1KMT2A
SCHEMBL9125329 0.89 MEN1 (0.53) MAPTLMNAPOLBMEN1KMT2A
SCHEMBL10671345 0.89 MEN1 (0.50) MAPTLMNAPOLBGLO1GAA
SCHEMBL10671337 0.89 MEN1 (0.50) MAPTLMNAPOLBGLO1GAA
SCHEMBL10376451 0.87 EGFR (0.56) MAPTLMNAPOLBGLO1GAA
SCHEMBL4573284 0.85 ALOX5 (0.48) MAPTLMNAPOLBGAATDP1

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-4722931-A MUSCLE RELAXANTS LABORATORIOS DELAGRANGE (ES) 1988-02-02 US disclosed