SCHEMBL20424070

SCHEMBL20424070

CC1(O)CCN(c2cc3c(cnn3C3CCCCO3)cc2Cl)CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 10/20 0.45
▸ RXRA P19793 1/20 0.43
▸ RXRB P28702 1/20 0.43
▸ RXRG P48443 1/20 0.43
▸ CYP4F2 P78329 2/20 0.37
▸ CYP4A11 Q02928 2/20 0.37
▸ DGAT2 Q96PD7 1/20 0.36
▸ ATR Q13535 5/20 0.35
▸ ABCG2 Q9UNQ0 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ POLB P06746 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
SCHEMBL20424063 0.94 LRRK2 (0.49) LRRK2RXRARXRBRXRGCYP4F2
SCHEMBL21796742 0.87 RXRA (0.41) LRRK2RXRARXRBRXRGATR
SCHEMBL22765293 0.86 RXRA (0.43) LRRK2RXRARXRBRXRGCYP4F2
SCHEMBL29538787 0.86 RXRA (0.43) LRRK2RXRARXRBRXRGCYP4F2
SCHEMBL22749867 0.85 LRRK2 (0.40) LRRK2RXRARXRBRXRGDGAT2
SCHEMBL22750191 0.82 LRRK2 (0.54) LRRK2RXRARXRBRXRGABCG2
SCHEMBL22749844 0.81 RXRA (0.43) LRRK2RXRARXRBRXRGATR
SCHEMBL29796145 0.80 GPR119 (0.42) RXRARXRBRXRGLMNA
SCHEMBL22749636 0.80 GPR119 (0.42) RXRARXRBRXRGLMNA
SCHEMBL25340718 0.78 ATR (0.44) LRRK2RXRARXRBRXRGATR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10858367-B2 Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-12-08 — — US disclosed
US-10858367-B2 Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-12-08 — — US disclosed
WO-2018137593-A1 COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-08-02 — — WO disclosed
WO-2018137593-A1 COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-08-02 — — WO 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-10858367-B2 Compounds LRRK2, PARK7, PINK1 LRRK2 1/4885RXRA 4584/4885RXRB 4530/4885

“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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