SCHEMBL6805426

SCHEMBL6805426

CC1CC[C@](CN)(CC(=O)O)[C@@H]1C

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
BLM P54132 1/20 0.39
CACNA2D1 P54289 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL5438031 1.00 CYP1A2 (0.39) CYP1A2USP2ALDH1A1LMNATSHR
SCHEMBL5436252 1.00 CYP1A2 (0.39) CYP1A2USP2ALDH1A1LMNATSHR
SCHEMBL5437305 1.00 CYP1A2 (0.39) CYP1A2USP2ALDH1A1LMNATSHR
SCHEMBL6805031 1.00 CYP1A2 (0.39) CYP1A2USP2ALDH1A1LMNATSHR
SCHEMBL14459031 1.00 CYP1A2 (0.39) CYP1A2USP2ALDH1A1LMNATSHR
SCHEMBL5441803 1.00 CYP1A2 (0.39) CYP1A2USP2ALDH1A1LMNATSHR
SCHEMBL5437213 1.00 CYP1A2 (0.39) CYP1A2USP2ALDH1A1LMNATSHR
SCHEMBL16306576 0.90 CYP1A2 (0.44) CYP1A2USP2ALDH1A1LMNATSHR
SCHEMBL15308541 0.90 CYP1A2 (0.44) CYP1A2USP2ALDH1A1LMNATSHR
SCHEMBL15894815 0.84 CYP1A2 (0.40) CYP1A2

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-20040132636-A1 Pharmaceutical uses for alpha2delta ligands DOOLEY DAVID JAMES (US) 2004-07-08 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-20040132636-A1 Pharmaceutical uses for alpha2delta ligands ADRA1D, OPRD1, ADRA1A CYP1A2 438/4885USP2 4293/4885ALDH1A1 220/4885

“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.