SCHEMBL19753629

SCHEMBL19753629

CCC(NCCNC1CCN(c2nccc3ccc(F)cc23)CC1)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 5/20 0.37
▸ OPRL1 P41146 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
SCHEMBL17847601 0.90 PDE10A (0.38) OPRK1
SCHEMBL17865139 0.88 APLNR (0.37) OPRK1
SCHEMBL17847555 0.87 VCP (0.38) OPRK1
Lithium Ion SCHEMBL17847540 0.86 HTR7 (0.34) OPRK1
SCHEMBL17865173 0.86 HDAC3 (0.40) OPRK1
SCHEMBL19743155 0.76 CCNE1 (0.36) —
SCHEMBL17847631 0.73 ROCK2 (0.36) —
SCHEMBL17847596 0.73 ROCK2 (0.36) —
SCHEMBL17865170 0.72 CCR3 (0.46) —
SCHEMBL17847626 0.72 MEN1 (0.38) —

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-20170368017-A1 ANTIBACTERIAL COMPOUNDS AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 2017-12-28 — — 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-20170368017-A1 ANTIBACTERIAL COMPOUNDS MRPL21, CLPP, NRDC OPRK1 2434/4885OPRL1 1929/4885

“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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