SCHEMBL19834066

SCHEMBL19834066

O=C1COc2cc(F)c(C(=O)N3CC(COc4ccc(Br)cc4Cl)C3)cc2N1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 16/20 0.57
▸ RECQL P46063 1/20 0.39
▸ TP53 P04637 1/20 0.38
▸ ADRB1 P08588 1/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ HTR1D P28221 1/20 0.38
▸ HTR1B P28222 1/20 0.38
▸ HTR7 P34969 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ HTR6 P50406 1/20 0.38

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
SCHEMBL19833965 0.92 MGLL (0.49) MGLLADRB1HTR1ADRD2HTR1D
SCHEMBL19834079 0.92 MGLL (0.57) MGLLADRB1HTR1ADRD2HTR1D
SCHEMBL19833794 0.92 MGLL (0.67) MGLL
SCHEMBL19833726 0.92 MGLL (0.58) MGLLTP53ADRB1HTR1ADRD2
SCHEMBL19833711 0.89 MGLL (0.57) MGLLTP53HTR1AHTR1DHTR1B
SCHEMBL19833782 0.89 MGLL (0.55) MGLL
SCHEMBL19833959 0.89 MGLL (0.55) MGLLTP53DRD2DRD3
SCHEMBL19834037 0.88 MGLL (0.51) MGLLTP53ADRB1HTR1ADRD2
SCHEMBL19834164 0.88 MGLL (0.54) MGLLTP53ADRB1HTR1ADRD2
SCHEMBL19833999 0.87 MGLL (0.53) MGLLTP53ADRB1HTR1ADRD2

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
EP-3279191-B1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2020-09-02 — — EP disclosed
US-10106556-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-10-23 — — US disclosed
US-20180079756-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-03-22 — — US disclosed
EP-3279191-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2018-02-07 — — 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 (2 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-20180079756-A1 HETEROCYCLIC COMPOUND MAG, ACHE, HTT MGLL 129/4885RECQL 1660/4885TP53 1722/4885
US-10106556-B2 Heterocyclic compound MAG, ACHE, HTT MGLL 129/4885RECQL 1660/4885TP53 1722/4885

“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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