SCHEMBL13168164

SCHEMBL13168164

CCN1CCC2(CCN(c3cc(C)nc(C)c3)CC2)C1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ OGA O60502 11/20 0.52
▸ TSHR P16473 1/20 0.40
▸ TMEM97 Q5BJF2 1/20 0.39
▸ LRRK2 Q5S007 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.35
▸ FFAR4 Q5NUL3 1/20 0.35
▸ GAA P10253 1/20 0.34
▸ RAD52 P43351 1/20 0.34

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
SCHEMBL13168224 0.83 OGA (0.46) OGATSHRTMEM97LRRK2GAA
SCHEMBL14996505 0.80 OGA (0.43) OGATSHRTMEM97LRRK2ALDH1A1
SCHEMBL13131064 0.77 OGA (0.42) OGATSHRTMEM97LRRK2FFAR4
SCHEMBL12944876 0.77 CYP2C9 (0.52) TSHRALDH1A1
SCHEMBL11955033 0.74 KMT2A (0.51) ALDH1A1GAARAD52
SCHEMBL13168229 0.73 PHGDH (0.41) OGATSHRGAARAD52
SCHEMBL13168325 0.72 CHRNB2 (0.50) —
SCHEMBL20468836 0.72 OGA (0.48) OGATSHRLRRK2ALDH1A1
SCHEMBL11956175 0.72 CYP2D6 (0.53) TSHRALDH1A1
SCHEMBL22359000 0.72 TSHR (0.59) TSHRGAA

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-20100249095-A1 Substituted Spiro-amide Compounds GRUENENTHAL GMBH (DE) 2010-09-30 — — 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-20100249095-A1 Substituted Spiro-amide Compounds BDKRB1, BDKRB2, REN OGA 3406/4885TSHR 338/4885TMEM97 1662/4885

“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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