SCHEMBL20259366

SCHEMBL20259366

COC(=O)[C@H]1CCc2c(sc3ncnc(Cl)c23)C1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 5/20 0.60
CSNK2A2 P19784 3/20 0.47
CSNK2B P67870 3/20 0.47
CSNK2A1 P68400 3/20 0.47
MKNK1 Q9BUB5 9/20 0.47
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.44
MAPT P10636 1/20 0.43

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
SCHEMBL15115808 0.91 LIMK1 (0.49) LIMK1CSNK2A2CSNK2BCSNK2A1MKNK1
SCHEMBL15933742 0.89 LIMK1 (0.77) LIMK1CSNK2A2CSNK2BCSNK2A1MKNK1
SCHEMBL16751134 0.89 LIMK1 (0.77) LIMK1CSNK2A2CSNK2BCSNK2A1MKNK1
SCHEMBL16384793 0.89 LIMK1 (0.77) LIMK1CSNK2A2CSNK2BCSNK2A1MKNK1
SCHEMBL5629554 0.89 LIMK1 (0.77) LIMK1CSNK2A2CSNK2BCSNK2A1MKNK1
SCHEMBL18135597 0.87 LIMK1 (0.61) LIMK1CSNK2A2CSNK2BCSNK2A1MKNK1
SCHEMBL18135594 0.87 LIMK1 (0.64) LIMK1CSNK2A2CSNK2BCSNK2A1MKNK1
SCHEMBL18135596 0.87 LIMK1 (0.64) LIMK1CSNK2A2CSNK2BCSNK2A1MKNK1
SCHEMBL16384794 0.86 LIMK1 (0.59) LIMK1CSNK2A2CSNK2BCSNK2A1MKNK1
SCHEMBL16370982 0.86 LIMK1 (0.59) LIMK1CSNK2A2CSNK2BCSNK2A1MKNK1

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-20180162877-A1 PYRAZOLOPYRIDINAMINES AS MKNK1 AND MKNK2 INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-06-14 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-20180162877-A1 PYRAZOLOPYRIDINAMINES AS MKNK1 AND MKNK2 INHIBITORS MKNK1, MKNK2, MAP4K5 LIMK1 287/4885CSNK2A2 228/4885CSNK2B 236/4885

“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.