SCHEMBL2617801

SCHEMBL2617801

N#Cc1ccc(OC2CCC(OCC(=S)N3CCN(c4ccc(Cl)cn4)CC3)CC2)cc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RET P07949 6/20 0.41
AR P10275 12/20 0.41
PRKAA2 P54646 2/20 0.39

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
SCHEMBL2119470 1.00 RET (0.41) RETARPRKAA2
SCHEMBL2617867 1.00 RET (0.41) RETARPRKAA2
SCHEMBL2617866 0.91 AR (0.46) RETARPRKAA2
SCHEMBL2617865 0.91 SMN1; SMN2 (0.43) RETARPRKAA2
SCHEMBL2119282 0.91 SMN1; SMN2 (0.43) RETARPRKAA2
SCHEMBL2119410 0.91 AR (0.46) RETARPRKAA2
SCHEMBL2617802 0.91 SMN1; SMN2 (0.43) RETARPRKAA2
SCHEMBL2617778 0.91 PRKAA2 (0.42) RETARPRKAA2
SCHEMBL2617835 0.91 PRKAA2 (0.42) RETARPRKAA2
SCHEMBL2120388 0.91 PRKAA2 (0.42) RETARPRKAA2

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-8507474-B2 Anthelmintic agents and their use INTERVET INTERNATIONAL B.V. (NL) 2013-08-13 US disclosed
US-20120094981-A1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INTERNATIONAL B.V. (NL) 2012-04-19 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-20120094981-A1 ANTHELMINTIC AGENTS AND THEIR USE ABCB11, ACHE, CMA1 RET 4682/4885AR 4346/4885PRKAA2 4495/4885

“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.