SCHEMBL16341390

SCHEMBL16341390

COc1ccc(Cn2cc(C(=O)NCC(O)c3ccccc3)c(=O)c3c(F)ccc(F)c32)cc1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 10/20 0.66
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ LMNA P02545 1/20 0.42
▸ TAAR1 Q96RJ0 1/20 0.41
▸ BCHE P06276 3/20 0.40
▸ ACHE P22303 3/20 0.40
▸ KLKB1 P03952 1/20 0.40
▸ CNR1 P21554 1/20 0.39
▸ CNR2 P34972 1/20 0.39

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
SCHEMBL16341624 0.88 CHRM1 (0.69) CHRM1SMN1; SMN2LMNAKLKB1
SCHEMBL16341771 0.88 CHRM1 (0.69) CHRM1SMN1; SMN2LMNAKLKB1
SCHEMBL16340940 0.86 CHRM1 (0.67) CHRM1SMN1; SMN2LMNAKLKB1
SCHEMBL16341874 0.83 CHRM1 (0.74) CHRM1SMN1; SMN2KDM4ETDP1LMNA
SCHEMBL16341768 0.82 CHRM1 (0.72) CHRM1SMN1; SMN2BCHEACHECNR1
SCHEMBL16341521 0.82 CHRM1 (0.72) CHRM1SMN1; SMN2KDM4ELMNABCHE
SCHEMBL16341587 0.82 CHRM1 (0.74) CHRM1SMN1; SMN2LMNACNR1CNR2
SCHEMBL16341842 0.82 CHRM1 (0.78) CHRM1SMN1; SMN2LMNA
SCHEMBL16340960 0.81 CHRM1 (0.69) CHRM1SMN1; SMN2KDM4ELMNA
SCHEMBL22416277 0.81 CHRM1 (0.58) CHRM1SMN1; SMN2

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-2821401-B1 DIHYDROQUINOLINONE COMPOUNDS AS MODULATORS OF THE MUSCARININC M1 RECEPTOR TAKEDA PHARMACEUTICALS CO (JP) 2020-09-09 — — EP disclosed
US-9403802-B2 Heterocyclic compound and use therefor TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-08-02 — — US disclosed
US-9403802-B2 Heterocyclic compound and use therefor TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-08-02 — — US disclosed
US-9403802-B2 Heterocyclic compound and use therefor TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-08-02 — — US disclosed
US-20150126487-A1 HETEROCYCLIC COMPOUND AND USE THEREFOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-05-07 — — US disclosed
US-20150126487-A1 HETEROCYCLIC COMPOUND AND USE THEREFOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-05-07 — — US disclosed
US-20150126487-A1 HETEROCYCLIC COMPOUND AND USE THEREFOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-05-07 — — US disclosed
EP-2821401-A1 HETEROCYCLIC COMPOUND AND USE THEREFOR Takeda Pharmaceutical Company Limited (JP) 2015-01-07 — — 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 (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-20150126487-A1 HETEROCYCLIC COMPOUND AND USE THEREFOR CHRM1, CHRM4, CHRM2 CHRM1 1/4885SMN1; SMN2 2464/4885KDM4E 1528/4885

“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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