SCHEMBL1410340

SCHEMBL1410340

O=C(O)COC1CCN(c2ccc(F)c(C(F)(F)F)c2)C1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 10/20 0.64
▸ ACACB O00763 3/20 0.55
▸ LIPG Q9Y5X9 4/20 0.43
▸ LPL P06858 1/20 0.43
▸ AR P10275 1/20 0.42
▸ FFAR1 O14842 1/20 0.42
▸ TTR P02766 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
Potassium Ion SCHEMBL1410342 0.89 NOTUM (0.58) NOTUMACACBLIPGLPL
SCHEMBL12210031 0.88 NOTUM (0.65) NOTUM
SCHEMBL1410270 0.87 NOTUM (0.64) NOTUM
SCHEMBL1410148 0.82 NOTUM (0.60) NOTUMLIPGLPL
SCHEMBL21624804 0.81 NOTUM (0.63) NOTUMACACBAR
SCHEMBL21624800 0.81 NOTUM (0.63) NOTUMACACBAR
SCHEMBL12210057 0.81 NOTUM (0.63) NOTUMACACBLIPGLPL
SCHEMBL1410218 0.80 FFAR4 (0.52) NOTUMLIPGLPL
SCHEMBL1409535 0.80 FFAR4 (0.52) NOTUMLIPGLPL
SCHEMBL1410475 0.80 FFAR4 (0.52) NOTUMLIPGLPL

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
EP-2295406-B1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL (JP) 2014-04-23 — — EP 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-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

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 NOTUM 874/4885ACACB 1733/4885LIPG 3938/4885

“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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