SCHEMBL1250049

SCHEMBL1250049

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

nearest known ligand 0.79

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 4/20 0.79
▸ NR2E3 Q9Y5X4 3/20 0.52
▸ CHEK2 O96017 2/20 0.52
▸ PRSS12 P56730 1/20 0.52
▸ TAS1R3 Q7RTX0 1/20 0.51
▸ TAS1R1 Q7RTX1 1/20 0.51
▸ TAS1R2 Q8TE23 1/20 0.51
▸ CHEK1 O14757 2/20 0.49
▸ KDR P35968 2/20 0.49
▸ MLLT1 Q03111 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ HDAC6 Q9UBN7 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
SCHEMBL1249718 0.91 DGAT1 (0.71) DGAT1NR2E3CHEK2PRSS12KDR
SCHEMBL1248774 0.88 DGAT1 (1.00) DGAT1NR2E3CHEK2PRSS12CHEK1
SCHEMBL1249930 0.87 DGAT1 (0.85) DGAT1NR2E3CHEK2PRSS12NPC1
SCHEMBL1251539 0.86 DGAT1 (0.84) DGAT1NR2E3CHEK2CHEK1KDR
SCHEMBL1251547 0.86 DGAT1 (0.84) DGAT1NR2E3CHEK2CHEK1KDR
SCHEMBL1248735 0.85 DGAT1 (0.69) DGAT1NR2E3CHEK2KDRHDAC6
SCHEMBL1250342 0.85 DGAT1 (0.82) DGAT1NR2E3CHEK2PRSS12KDR
SCHEMBL1249997 0.85 DGAT1 (0.82) DGAT1NR2E3CHEK2CHEK1KDR
SCHEMBL1250221 0.85 DGAT1 (0.85) DGAT1NR2E3CHEK2CHEK1KDR
SCHEMBL1251452 0.84 DGAT1 (0.80) 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 4 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
WO-2008048991-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2008-04-24 — — WO 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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