SCHEMBL31010237

SCHEMBL31010237

c1ccc(COc2ccc(CN3CCCCC3)cc2)nc1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 16/20 0.66
NPC1 O15118 1/20 0.56
MAPT P10636 1/20 0.56
HTT P42858 1/20 0.56
RAB9A P51151 1/20 0.56
TSHR P16473 1/20 0.54
ACHE P22303 1/20 0.54
RAD52 P43351 1/20 0.54

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
SCHEMBL30448278 0.81 L3MBTL1 (0.54) HRH3TSHR
SCHEMBL3161186 0.78 CYP2C19 (0.65) MAPTTSHR
SCHEMBL13150495 0.78 NPC1 (0.67) HRH3NPC1MAPTHTTRAB9A
SCHEMBL13212998 0.78 MCHR1 (0.46) HRH3NPC1MAPTHTTRAB9A
SCHEMBL1365779 0.78 MCHR1 (0.68) HRH3
SCHEMBL28752703 0.78 CXCR4 (0.74) HRH3TSHR
SCHEMBL30461991 0.77 ALDH1A1 (0.59) NPC1MAPTRAB9ATSHR
SCHEMBL511292 0.77 ALDH1A1 (0.59) NPC1MAPTRAB9ATSHR
SCHEMBL10205701 0.77 MCHR1 (0.51) HRH3
SCHEMBL31106560 0.77 CYP1A2 (0.67) MAPTTSHR

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-20240245670-A1 DOSING REGIMEN AND PHARMACEUTICAL COMBINATION COMPRISING 3-(1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE DERIVATIVES NOVARTIS AG (CH) 2024-07-25 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-20240245670-A1 DOSING REGIMEN AND PHARMACEUTICAL COMBINATION COMPRISING 3-(1-OXOISOINDOLIN-2-YL)PIPERIDINE-2,6-DIONE DERIVATIVES IKZF1, IKZF2, IKZF3 HRH3 4782/4885NPC1 568/4885MAPT 3059/4885

“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.