SCHEMBL462625

SCHEMBL462625

O=C(NCCNC(=O)C1CCN(C(=O)c2ccccc2)CC1)c1cn(-c2ccccc2)nc1C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 16/20 0.57
▸ KMT2A Q03164 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ HTR1A P08908 1/20 0.45
▸ HTR1B P28222 1/20 0.45
▸ HTR2A P28223 1/20 0.45
▸ HTR2C P28335 1/20 0.45
▸ HTR2B P41595 1/20 0.45

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
SCHEMBL438295 0.95 DGAT1 (0.55) DGAT1KMT2ALMNA
SCHEMBL462759 0.90 DGAT1 (0.57) DGAT1
SCHEMBL438841 0.88 DGAT1 (0.61) DGAT1
SCHEMBL463713 0.88 DGAT1 (0.60) DGAT1
SCHEMBL438840 0.88 DGAT1 (0.61) DGAT1
SCHEMBL440950 0.88 DGAT1 (0.54) DGAT1
SCHEMBL438558 0.87 DGAT1 (0.54) DGAT1
SCHEMBL438605 0.87 DGAT1 (0.56) DGAT1LMNA
SCHEMBL438564 0.87 DGAT1 (0.56) DGAT1
SCHEMBL440048 0.87 DGAT1 (0.60) DGAT1

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-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 — — US disclosed
US-20120065196-A1 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-15 — — 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-20120065196-A1 AMIDE COMPOUNDS DGAT2, DGAT1, DLAT DGAT1 2/4885KMT2A 667/4885LMNA 4016/4885

“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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