SCHEMBL2617835

SCHEMBL2617835

N#Cc1ccc(O[C@H]2CC[C@H](OCC(=O)N3CCN(c4ccc(Cl)cn4)CC3)CC2)cc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRKAA2 P54646 2/20 0.42
IDE P14735 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RET P07949 4/20 0.41
AR P10275 9/20 0.41
AOC3 Q16853 1/20 0.40
SCN9A Q15858 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
TIPARP Q7Z3E1 1/20 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
SCHEMBL2617778 1.00 PRKAA2 (0.42) PRKAA2IDESMN1; SMN2RETAR
SCHEMBL2120388 1.00 PRKAA2 (0.42) PRKAA2IDESMN1; SMN2RETAR
SCHEMBL2617832 0.91 SMN1; SMN2 (0.51) PRKAA2IDESMN1; SMN2RETAR
SCHEMBL2120603 0.91 AR (0.50) PRKAA2IDESMN1; SMN2ARTIPARP
SCHEMBL2617834 0.91 AR (0.50) PRKAA2IDESMN1; SMN2ARTIPARP
SCHEMBL2617777 0.91 SMN1; SMN2 (0.51) PRKAA2IDESMN1; SMN2RETAR
SCHEMBL2120802 0.91 SMN1; SMN2 (0.51) PRKAA2IDESMN1; SMN2RETAR
SCHEMBL2119470 0.91 RET (0.41) PRKAA2RETAR
SCHEMBL2617867 0.91 RET (0.41) PRKAA2RETAR
SCHEMBL2617801 0.91 RET (0.41) PRKAA2RETAR

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-8507474-B2 Anthelmintic agents and their use INTERVET INTERNATIONAL B.V. (NL) 2013-08-13 US disclosed
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
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 PRKAA2 4495/4885IDE 1072/4885SMN1; SMN2 4488/4885

“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.