SCHEMBL24155536

SCHEMBL24155536

c1ccc(Oc2ncc(-c3ccc4ncncc4c3)cn2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 3/20 0.61
▸ PIK3CD O00329 2/20 0.61
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ GAA P10253 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ EGFR P00533 5/20 0.47
▸ TDO2 P48775 1/20 0.46
▸ FGFR4 P22455 1/20 0.44
▸ HPGDS O60760 5/20 0.42
▸ PIK3CB P42338 1/20 0.41
▸ MTOR P42345 1/20 0.41
▸ PIK3CG P48736 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ FTO Q9C0B1 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ KDM4E B2RXH2 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
SCHEMBL24155661 0.82 NPC1 (0.60) PIK3CAPIK3CDMEN1KMT2ANPC1
SCHEMBL20687402 0.80 PIK3CD (0.73) PIK3CAPIK3CDNPC1RAB9AEGFR
SCHEMBL24155896 0.80 MEN1 (0.55) MEN1KMT2ANPC1GAARAB9A
SCHEMBL24155533 0.79 MEN1 (0.54) PIK3CAPIK3CDMEN1KMT2ANPC1
SCHEMBL8644295 0.78 PIK3CA (0.73) PIK3CAPIK3CDNPC1RAB9AEGFR
SCHEMBL24156361 0.77 MEN1 (0.58) PIK3CDMEN1KMT2ANPC1GAA
Diphenylether SCHEMBL28398421 0.74 EGFR (0.74) PIK3CAPIK3CDKMT2AEGFRHTT
SCHEMBL24156338 0.73 NPC1 (0.54) MEN1KMT2ANPC1GAARAB9A
SCHEMBL17231469 0.73 PIK3CA (0.67) PIK3CAPIK3CDNPC1RAB9AEGFR
SCHEMBL24155468 0.72 NPC1 (0.58) PIK3CDMEN1KMT2ANPC1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210403456-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF EPILEPSY OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2021-12-30 — — US 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-20210403456-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF EPILEPSY SLC6A11, SCN1A, SCN1B PIK3CA 3791/4885PIK3CD 3693/4885MEN1 450/4885

“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.

Send feedback