SCHEMBL22729465

SCHEMBL22729465

COc1ccc(Cn2cc(C)n3ncc(C(=O)Nc4ccc(N5CCOCC5)cc4)c3c2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.51
▸ HIF1A Q16665 1/20 0.49
▸ EPAS1 Q99814 1/20 0.49
▸ PDE10A Q9Y233 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.48
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ HCRTR1 O43613 1/20 0.46
▸ PDE7A Q13946 1/20 0.45
▸ RAB9A P51151 4/20 0.45
▸ LMNA P02545 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ GALR3 O60755 1/20 0.45
▸ L3MBTL1 Q9Y468 2/20 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
SCHEMBL22729551 0.82 MAPT (0.51) MAPTPDE10AALDH1A1MEN1KMT2A
SCHEMBL22729751 0.82 MAPT (0.51) MAPTPDE10AALDH1A1KMT2ARAB9A
SCHEMBL22729636 0.81 MAPT (0.55) MAPTPDE10AALDH1A1RAB9ALMNA
SCHEMBL29839342 0.78 KMT2A (0.53) MAPTPDE10AALDH1A1MEN1KMT2A
SCHEMBL22729798 0.78 KMT2A (0.53) MAPTPDE10AALDH1A1MEN1KMT2A
SCHEMBL22729785 0.77 CHRM1 (0.51) MAPTALDH1A1LMNAKDM4E
SCHEMBL22729625 0.75 PDE10A (0.49) MAPTPDE10AALDH1A1MEN1KMT2A
SCHEMBL29839336 0.75 PDE10A (0.49) MAPTPDE10AALDH1A1MEN1KMT2A
SCHEMBL22755057 0.75 MAPT (0.53) MAPTALDH1A1MEN1KMT2AHCRTR1
SCHEMBL22729508 0.74 MAPT (0.54) MAPTALDH1A1RAB9ALMNASMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11459325-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-10-04 — — US disclosed
US-20210087186-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-03-25 — — US disclosed
US-20210087186-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-03-25 — — US disclosed
EP-3747885-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2020-12-09 — — 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-20210087186-A1 HETEROCYCLIC COMPOUND GBA1, GBA2, GALC MAPT 356/4885HIF1A 2823/4885EPAS1 3516/4885
US-11459325-B2 Heterocyclic compound GBA1, GBA2, GALC MAPT 364/4885HIF1A 2814/4885EPAS1 3493/4885

“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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