SCHEMBL1250987

SCHEMBL1250987

C=Cc1ccc(NC(=O)c2ccc3nc(-c4c(Cl)cccc4Cl)[nH]c3c2)cc1

nearest known ligand 0.79

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 5/20 0.79
▸ NR2E3 Q9Y5X4 3/20 0.52
▸ CHEK2 O96017 2/20 0.52
▸ CHEK1 O14757 2/20 0.49
▸ KDR P35968 2/20 0.49
▸ CYP3A4 P08684 1/20 0.47
▸ HPSE Q9Y251 1/20 0.47
▸ PRSS12 P56730 2/20 0.46

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
SCHEMBL1248774 0.88 DGAT1 (1.00) DGAT1NR2E3CHEK2CHEK1KDR
SCHEMBL1249930 0.87 DGAT1 (0.85) DGAT1NR2E3CHEK2CYP3A4HPSE
SCHEMBL1251539 0.86 DGAT1 (0.84) DGAT1NR2E3CHEK2CHEK1KDR
SCHEMBL1251547 0.86 DGAT1 (0.84) DGAT1NR2E3CHEK2CHEK1KDR
SCHEMBL1250342 0.85 DGAT1 (0.82) DGAT1NR2E3CHEK2KDRHPSE
SCHEMBL1249997 0.85 DGAT1 (0.82) DGAT1NR2E3CHEK2CHEK1KDR
SCHEMBL1250221 0.85 DGAT1 (0.85) DGAT1NR2E3CHEK2CHEK1KDR
SCHEMBL1251452 0.84 DGAT1 (0.80) DGAT1NR2E3CHEK2CHEK1KDR
SCHEMBL1250343 0.84 DGAT1 (0.80) DGAT1NR2E3CHEK2KDRCYP3A4
SCHEMBL1251640 0.84 DGAT1 (0.79) DGAT1NR2E3CHEK2CHEK1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8222248-B2 Organic compounds NOVARTIS AG (CH) 2012-07-17 — — US disclosed
US-20110046133-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-02-24 — — US disclosed
US-20110046133-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-02-24 — — 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-20110046133-A1 ORGANIC COMPOUNDS DGAT1, DGAT2, SOAT1 DGAT1 1/4885NR2E3 1657/4885CHEK2 4427/4885

“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.

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