SCHEMBL31010286

SCHEMBL31010286

CCn1ccc(CN2CCCCC2)n1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.42
ALDH1A1 P00352 6/20 0.39
KDM4E B2RXH2 3/20 0.39
MEN1 O00255 1/20 0.39
GFER P55789 1/20 0.39
KMT2A Q03164 1/20 0.39
HRH4 Q9H3N8 1/20 0.39
KCNH2 Q12809 1/20 0.38
TSHR P16473 2/20 0.37
MAPT P10636 1/20 0.37
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL807360 0.79 DDB1 (0.53) HRH3ALDH1A1KDM4EHRH4KCNH2
SCHEMBL28280992 0.77 ALDH1A1 (0.39) HRH3ALDH1A1KDM4EHRH4TSHR
SCHEMBL23862491 0.75 CYP1A2 (0.44) HRH3HRH4L3MBTL1
Ammonia Solution, Strong SCHEMBL27718462 0.71 ALDH1A1 (0.40) ALDH1A1KMT2AKCNH2TSHRMAPT
SCHEMBL859959 0.71
Hydrochloric Acid SCHEMBL6231685 0.71 ALDH1A1 (0.40) ALDH1A1KMT2AKCNH2TSHRMAPT
SCHEMBL294058 0.71 KCNH2 (0.35) ALDH1A1KMT2AKCNH2TSHRMAPT
SCHEMBL4324417 0.70
SCHEMBL21945129 0.70 KCNH2 (0.37) ALDH1A1KMT2AKCNH2TSHRMAPT
SCHEMBL5149586 0.68 HRH3 (0.43) HRH3ALDH1A1MAPT

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 4782/4885ALDH1A1 2942/4885KDM4E 345/4885

“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.