SCHEMBL6714830

SCHEMBL6714830

COC(=O)c1ccc(-c2ccc(OC)cc2)nc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.75
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
MAPK1 P28482 2/20 0.54
MAPT P10636 4/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
CHEK1 O14757 1/20 0.52
KDM4E B2RXH2 3/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
NPC1 O15118 1/20 0.51
LMNA P02545 1/20 0.51
ALPL P05186 1/20 0.51
RAB9A P51151 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
CSNK2A2 P19784 1/20 0.50
CSNK2A1 P68400 1/20 0.50
DGAT1 O75907 1/20 0.49
HPGDS O60760 1/20 0.49
CYP1A2 P05177 1/20 0.49

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
SCHEMBL4468880 0.91 RXFP1 (0.66) RXFP1CA1CA2MAPK1MAPT
SCHEMBL29598250 0.90 MAPK1 (0.61) RXFP1CA1CA2MAPK1MAPT
SCHEMBL1179665 0.87 CYP11B1 (0.66) RXFP1CA1CA2MAPK1MAPT
SCHEMBL29597984 0.86 RXFP1 (0.56) RXFP1CA1CA2MAPK1MAPT
SCHEMBL29738264 0.86 RXFP1 (0.77) RXFP1CA1CA2SMN1; SMN2CHEK1
SCHEMBL21033709 0.86 TDP1 (0.59) RXFP1MAPK1MAPTSMN1; SMN2KDM4E
SCHEMBL4228868 0.86 RXFP1 (0.77) RXFP1CA1CA2SMN1; SMN2CHEK1
SCHEMBL5128240 0.85 RXFP1 (0.56) RXFP1MAPK1MAPTSMN1; SMN2KDM4E
SCHEMBL29596790 0.85 RXFP1 (0.56) RXFP1MAPK1MAPTSMN1; SMN2KDM4E
SCHEMBL1758177 0.84 RXFP1 (0.75) RXFP1CA1CA2CHEK1HPGDS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112048734-B Regioselective electrochemical synthesis method of nitrogen-containing aromatic heterocyclic carboxylic ester 四川大学 2022-06-10 CN disclosed
US-20040006141-A1 Amidocarboxylic acid compounds SANKYO COMPANY, LTD (JP) 2004-01-08 US disclosed
US-6528525-B1 Amidocarboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2003-03-04 US disclosed
EP-1026149-A1 AMIDOCARBOXYLIC ACID DERIVATIVES Sankyo Company Limited (JP) 2000-08-09 EP 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-20040006141-A1 Amidocarboxylic acid compounds NR1H2, AGK, APOL1 RXFP1 779/4885CA1 3246/4885CA2 2273/4885

“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.