SCHEMBL927581

SCHEMBL927581

COC(=O)c1ccc(OCCC2CC2)cc1

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.70
RAB9A P51151 3/20 0.62
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
KDM4E B2RXH2 3/20 0.52
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
NPC1 O15118 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 1/20 0.49
HTT P42858 1/20 0.49
ACACB O00763 1/20 0.49

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
SCHEMBL9592656 0.87 MAPT (0.60) MAPTRAB9ATDP1L3MBTL1KDM4E
SCHEMBL9592644 0.87 MAPT (0.60) MAPTRAB9ATDP1L3MBTL1KDM4E
SCHEMBL9592503 0.86 MAPT (0.59) MAPTRAB9ANPC1
SCHEMBL9592510 0.86 MAPT (0.59) MAPTRAB9ANPC1
SCHEMBL10425372 0.85 MAPT (0.62) MAPTRAB9ATDP1L3MBTL1KDM4E
SCHEMBL9590586 0.85 MAPT (0.57) MAPTRAB9A
SCHEMBL9590594 0.85 MAPT (0.57) MAPTRAB9A
SCHEMBL927657 0.84 PARP15 (0.66) MAPTRAB9ATDP1L3MBTL1CA1
SCHEMBL1951546 0.83 MAPT (1.00) MAPTRAB9ATDP1L3MBTL1KDM4E
SCHEMBL7402974 0.83 GPR119 (0.64) MAPTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110015225-A1 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-20 US disclosed
EP-2261213-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-12-15 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-20110015225-A1 Heterocyclic compound MC1R, MCHR1, MCHR2 MAPT 2592/4885RAB9A 858/4885TDP1 4129/4885

“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.