SCHEMBL4224771

SCHEMBL4224771

CCNCC1CCC(OC)CC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SAT1 P21673 1/20 0.50
▸ GRM1 Q13255 1/20 0.33
▸ JAK2 O60674 1/20 0.32
▸ JAK1 P23458 1/20 0.32
▸ TYK2 P29597 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ DAO P14920 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.31
▸ GNAI3 P08754 1/20 0.31
▸ GNAO1 P09471 1/20 0.31
▸ GNAI1 P63096 1/20 0.31
▸ EPHX2 P34913 1/20 0.30
▸ HCRTR2 O43614 1/20 0.30

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
SCHEMBL4224780 1.00 SAT1 (0.50) SAT1GRM1JAK2JAK1TYK2
SCHEMBL24080019 0.89 SAT1 (0.40) SAT1GRM1MEN1KMT2ADAO
SCHEMBL124276 0.83 — —
Hydrochloric Acid SCHEMBL28865713 0.81 SAT1 (0.62) SAT1JAK2JAK1TYK2MEN1
Hydrochloric Acid SCHEMBL5395476 0.81 — —
SCHEMBL24129485 0.80 SAT1 (0.38) SAT1
SCHEMBL25994335 0.80 SAT1 (0.38) SAT1
SCHEMBL20871850 0.79 SAT1 (0.42) SAT1JAK2JAK1TYK2DAO
SCHEMBL23505958 0.77 DAO (0.33) SAT1DAO
SCHEMBL19698519 0.77 SAT1 (0.58) SAT1JAK2JAK1TYK2MEN1

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-20090075968-A1 CETP inhibitors SAKAKI JUNICHI 2009-03-19 — — US disclosed
CN-101389606-A Pyridinyl amine derivatives as inhibitors of cholesteryl ester transfer protein (CETP) NOVARTIS AG (CH) 2009-03-18 — — CN disclosed
EP-1968941-A1 PYRIDINYL AMINE DERIVATIVES AS INHIBITORS OF CHOLESTERYL ESTER TRANSFER PROTEIN (CETP) Novartis AG (CH) 2008-09-17 — — EP disclosed
WO-2007073934-A1 PYRIDINYL AMINE DERIVATIVES AS INHIBITORS OF CHOLESTERYL ESTER TRANSFER PROTEIN (CETP) NOVARTIS AG (CH) 2007-07-05 — — 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-20090075968-A1 CETP inhibitors CETP, PCSK9, MTTP SAT1 322/4885GRM1 4869/4885JAK2 4426/4885

“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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