SCHEMBL2517781

SCHEMBL2517781

O=C(O)CO[C@H]1CCN(c2ccc(Cl)cc2C(F)(F)F)C1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 16/20 0.49
▸ LPL P06858 6/20 0.49
▸ LIPC P11150 7/20 0.47
▸ NOTUM Q6P988 1/20 0.44
▸ TTR P02766 1/20 0.43
▸ KHK P50053 1/20 0.41
▸ PTGIR P43119 1/20 0.41

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
SCHEMBL12210096 0.88 LIPG (0.61) LIPGLPLLIPC
SCHEMBL1410302 0.88 LIPG (0.55) LIPGLPLLIPC
SCHEMBL1410556 0.87 LIPG (0.60) LIPGLPLLIPC
SCHEMBL12210053 0.84 NOTUM (0.49) LIPGLPLLIPCNOTUMTTR
SCHEMBL1409553 0.83 NOTUM (0.48) LIPGLPLLIPCNOTUMTTR
SCHEMBL1410600 0.81 LIPG (0.58) LIPGLPLLIPC
SCHEMBL12210031 0.80 NOTUM (0.65) NOTUM
SCHEMBL1410270 0.79 NOTUM (0.64) NOTUM
SCHEMBL1410340 0.79 NOTUM (0.64) LIPGLPLNOTUMTTR
SCHEMBL12210088 0.79 LIPG (0.61) LIPGLPLLIPC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8338622-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-12-25 — — US disclosed
US-8338622-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-12-25 — — US disclosed
US-8338622-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-12-25 — — US disclosed
US-20110251187-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-10-13 — — US disclosed
US-20110251187-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-10-13 — — US disclosed
US-20110251187-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-10-13 — — US disclosed
EP-2295406-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-03-16 — — EP disclosed
WO-2009145286-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2009-12-03 — — 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-20110251187-A1 HETEROCYCLIC COMPOUND NES, BMI1, DOT1L LIPG 3938/4885LPL 3718/4885LIPC 1690/4885

“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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