SCHEMBL6778380

SCHEMBL6778380

CCOc1ccccc1C(=O)Nc1cccnc1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SGMS2 Q8NHU3 16/20 0.76
ALDH1A1 P00352 1/20 0.67
MAPK1 P28482 1/20 0.67
HSD17B10 Q99714 1/20 0.67
RXFP1 Q9HBX9 2/20 0.66
KCNK3 O14649 1/20 0.63
KCNK9 Q9NPC2 1/20 0.63

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
SCHEMBL15528384 0.94 RXFP1 (0.77) SGMS2RXFP1
SCHEMBL17551879 0.92 SGMS2 (0.83) SGMS2
SCHEMBL17551875 0.87 SGMS2 (1.00) SGMS2
SCHEMBL30543377 0.87 SGMS2 (1.00) SGMS2
SCHEMBL31261727 0.87 SGMS2 (1.00) SGMS2
SCHEMBL17551870 0.86 SGMS2 (0.83) SGMS2
SCHEMBL30322947 0.86 SGMS2 (0.83) SGMS2
SCHEMBL22323774 0.85 MEN1 (0.67) SGMS2MAPK1HSD17B10RXFP1KCNK3
SCHEMBL30322841 0.85 SGMS2 (1.00) SGMS2ALDH1A1MAPK1HSD17B10
SCHEMBL19133749 0.85 SGMS2 (1.00) SGMS2ALDH1A1MAPK1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6780883-B2 ANTICHOLESTEROL AGENTS; CARDIOVASCULAR DISORDERS; ANTILIPEMIC AGENTS; RESTENOSIS; DIETETICS WARNER-LAMBERT COMPANY 2004-08-24 US disclosed
US-20020156281-A1 Amide inhibitors of microsomal triglyceride transfer protein BOOTH RICHARD JOHN (US) 2002-10-24 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-20020156281-A1 Amide inhibitors of microsomal triglyceride transfer protein CETP, MTTP, LCAT SGMS2 459/4885ALDH1A1 646/4885MAPK1 2199/4885

“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.