SCHEMBL12424264

SCHEMBL12424264

CC[C@H]1CC[C@](O)(CO)CC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
ESR2 Q92731 1/20 0.42
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
GAA P10253 2/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 1/20 0.32
ALOX12 P18054 1/20 0.32

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
SCHEMBL17835269 0.83 KDM4E (0.39) POLBKDM4EALDH1A1GAAHPGD
SCHEMBL3112772 0.80 ESR2 (0.45) ESR2
SCHEMBL20296743 0.79 POLB (0.41) POLBKDM4EALDH1A1GAAHPGD
SCHEMBL28573519 0.77 KDM4E (0.42) POLBKDM4EALDH1A1GAAHPGD
SCHEMBL25224328 0.76 ESR2 (0.42) ESR2
SCHEMBL17834069 0.76 KDM4E (0.35) POLBKDM4EALDH1A1GAAHPGD
SCHEMBL17815868 0.75
SCHEMBL178337 0.75 KDM4E (0.41) POLBESR2KDM4EALDH1A1GAA
SCHEMBL21743224 0.75 KDM4E (0.41) POLBESR2KDM4EALDH1A1GAA
SCHEMBL15014640 0.75 KDM4E (0.41) POLBESR2KDM4EALDH1A1GAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461328-B2 Tricyclic heterocyclic compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2013-06-11 US disclosed
US-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2011-08-18 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-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF CCNY, CCNA1, CCNA2 POLB 660/4885ESR2 790/4885KDM4E 2333/4885

“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.