SCHEMBL24156360

SCHEMBL24156360

c1ccc(Oc2ncc(-c3ccc4ncsc4c3)cn2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ RAB9A P51151 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ GAA P10253 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ IKBKB O14920 3/20 0.48
▸ DYRK1A Q13627 1/20 0.48
▸ HPGDS O60760 4/20 0.45
▸ VRK1 Q99986 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ RIPK1 Q13546 1/20 0.40
▸ MAPK14 Q16539 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ HKDC1 Q2TB90 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ ALKBH5 Q6P6C2 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
SCHEMBL24156334 0.89 MEN1 (0.52) MEN1NPC1RAB9AKMT2AGAA
SCHEMBL6032917 0.78 DYRK1A (0.62) NPC1RAB9AIKBKBDYRK1AVRK1
SCHEMBL21995555 0.77 FTO (0.68) NPC1RAB9ASMN1; SMN2HTTALKBH5
SCHEMBL8517411 0.77 IKBKB (0.55) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL24156361 0.77 MEN1 (0.58) MEN1NPC1RAB9AKMT2AGAA
SCHEMBL31214345 0.76 DYRK1A (0.72) NPC1RAB9ADYRK1AVRK1ALDH1A1
SCHEMBL24155661 0.73 NPC1 (0.60) MEN1NPC1RAB9AKMT2AGAA
SCHEMBL24155536 0.72 PIK3CA (0.61) MEN1NPC1RAB9AKMT2AGAA
SCHEMBL23480164 0.72 DYRK1A (0.57) NPC1RAB9AIKBKBDYRK1AVRK1
SCHEMBL2457178 0.72 DYRK1A (0.54) NPC1RAB9ADYRK1AVRK1RIPK1

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 MEN1 450/4885NPC1 1298/4885RAB9A 2321/4885

“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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