SCHEMBL6766898

SCHEMBL6766898

COc1ccc(COC(=O)c2ccc3c(c2)C(=O)N(Cc2ccc(C(=O)O)cc2)C3=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.61
CA2 P00918 4/20 0.56
CA9 Q16790 4/20 0.56
MEN1 O00255 1/20 0.56
HPGD P15428 1/20 0.56
KMT2A Q03164 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.54
CA1 P00915 3/20 0.53
CA4 P22748 2/20 0.53
CACNA1G O43497 2/20 0.53
CA12 O43570 1/20 0.53
ALDH1A1 P00352 1/20 0.51
NPC1 O15118 1/20 0.50
POLB P06746 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CASP3 P42574 1/20 0.49
MET P08581 1/20 0.48

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
SCHEMBL1418395 0.89 HPGD (0.71) ENPP2CA2CA9MEN1HPGD
SCHEMBL6766911 0.82 GAA (0.66) ENPP2CA2CA9MEN1HPGD
SCHEMBL6765613 0.81 MEN1 (0.52) CA2MEN1KMT2AL3MBTL1CA1
SCHEMBL10636593 0.79 NPC1 (0.71) CA2MEN1HPGDKMT2ACA1
SCHEMBL4239479 0.79 ENPP2 (0.88) ENPP2CA2CA9MEN1HPGD
SCHEMBL7399657 0.78 NPC1 (0.69) CA2MEN1HPGDKMT2ACA1
SCHEMBL20010530 0.78 KMT2A (0.88) ENPP2CA2CA9MEN1HPGD
SCHEMBL17890842 0.78 PARK7 (0.48) CA2CA9CA1CACNA1GCA12
SCHEMBL6766906 0.77 NPC1 (0.46) CA2MEN1HPGDKMT2AL3MBTL1
SCHEMBL3439592 0.77 ENPP2 (1.00) ENPP2CA2CA9MEN1HPGD

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-20040038973-A1 Treating osteoarthritis or rheumatoid arthritis NAHRA JOE (US) 2004-02-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040038973-A1 Treating osteoarthritis or rheumatoid arthritis MMP13, MMP11, MMP9 ENPP2 712/4885CA2 300/4885CA9 279/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.