SCHEMBL13043949

SCHEMBL13043949

CCOCC1(C(=O)N2CCc3ccc(C(F)(F)F)cc3C2)CCN(Cc2ccc3oc(=O)n(C)c3c2)C1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CCR2 P41597 17/20 0.35
▸ MGLL Q99685 1/20 0.34
▸ ACACB O00763 1/20 0.34
▸ KCNH2 Q12809 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
SCHEMBL1119889 0.93 CCR2 (0.36) CCR2MGLLACACBKCNH2
SCHEMBL1119765 0.89 CCR2 (0.39) CCR2KCNH2
SCHEMBL13809456 0.83 SMN1; SMN2 (0.34) —
SCHEMBL13011668 0.82 CCR2 (0.39) CCR2KCNH2
SCHEMBL13011667 0.82 CCR2 (0.39) CCR2KCNH2
SCHEMBL1120068 0.82 CCR2 (0.39) CCR2KCNH2
SCHEMBL13809452 0.82 KCNJ1 (0.32) —
SCHEMBL1119804 0.82 ALDH1A1 (0.42) —
SCHEMBL3746921 0.81 CYP3A4 (0.35) KCNH2
SCHEMBL1119970 0.80 CCR2 (0.40) CCR2KCNH2

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-20100286136-A1 DIHYDRONAPHTHYRIDINYL AND RELATED COMPOUNDS FOR USE IN TREATING OPHTHALMOLOGICAL DISORDERS JONES SIMON 2010-11-11 — — US disclosed
US-20100286136-A1 DIHYDRONAPHTHYRIDINYL AND RELATED COMPOUNDS FOR USE IN TREATING OPHTHALMOLOGICAL DISORDERS JONES SIMON 2010-11-11 — — 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-20100286136-A1 DIHYDRONAPHTHYRIDINYL AND RELATED COMPOUNDS FOR USE IN TREATING OPHTHALMOLOGICAL DISORDERS ALDH1A2, QDPR, PDE6C CCR2 3022/4885MGLL 4038/4885ACACB 3577/4885

“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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