SCHEMBL15534282

SCHEMBL15534282

CN(C)C(=O)C1CCc2c(sc3ncnc(Cl)c23)C1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 12/20 0.56
LIMK1 P53667 4/20 0.55
P2RX3 P56373 3/20 0.46
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL16741448 1.00 MKNK1 (0.56) MKNK1LIMK1P2RX3ALDH1A1LMNA
SCHEMBL16384777 1.00 MKNK1 (0.56) MKNK1LIMK1P2RX3ALDH1A1LMNA
SCHEMBL16372092 1.00 MKNK1 (0.56) MKNK1LIMK1P2RX3ALDH1A1LMNA
SCHEMBL16741394 0.89 LIMK1 (0.51) MKNK1LIMK1ALDH1A1LMNA
SCHEMBL15534999 0.89 MKNK1 (0.54) MKNK1LIMK1
SCHEMBL16708782 0.89 MKNK1 (0.54) MKNK1LIMK1
SCHEMBL16751173 0.89 LIMK1 (0.53) MKNK1LIMK1ALDH1A1LMNA
SCHEMBL16370982 0.85 LIMK1 (0.59) MKNK1LIMK1P2RX3ALDH1A1LMNA
SCHEMBL16741326 0.85 LIMK1 (0.59) MKNK1LIMK1P2RX3ALDH1A1LMNA
SCHEMBL15534269 0.85 LIMK1 (0.59) MKNK1LIMK1P2RX3ALDH1A1LMNA

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233866-B1 PYRAZOLOPYRIDINAMINES AS MKNK1 AND MKNK2 INHIBITORS Bayer Pharma AG (DE) 2021-04-21 EP disclosed
US-20180162877-A1 PYRAZOLOPYRIDINAMINES AS MKNK1 AND MKNK2 INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-06-14 US disclosed
EP-3233866-A1 PYRAZOLOPYRIDINAMINES AS MKNK1 AND MKNK2 INHIBITORS Bayer Pharma Aktiengesellschaft (DE) 2017-10-25 EP disclosed
US-9540392-B2 Thienopyrimidines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-01-10 US disclosed
WO-2016096721-A1 PYRAZOLOPYRIDINAMINES AS MKNK1 AND MKNK2 INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-06-23 WO disclosed
EP-2852595-B1 SUBSTITUTED BENZOTHIENOPYRIMIDINES Bayer Pharma AG (DE) 2016-06-22 EP disclosed
EP-2852596-B1 THIENOPYRIMIDINES Bayer Pharma AG (DE) 2016-06-22 EP disclosed
US-20160159789-A1 SUBSTITUTED PYRAZOLOPYRIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-06-09 US disclosed
EP-3019505-A1 SUBSTITUTED PYRAZOLO-PYRIDINAMINES Bayer Pharma Aktiengesellschaft (DE) 2016-05-18 EP disclosed
US-9296757-B2 Substituted benzothienopyrimidines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-03-29 US disclosed
US-20150152121-A1 Substituted Benzothienopyrimidines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-06-04 US disclosed
US-20150133425-A1 THIENOPYRIMIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-05-14 US disclosed
EP-2852596-A1 THIENOPYRIMIDINES Bayer Pharma Aktiengesellschaft (DE) 2015-04-01 EP disclosed
EP-2852595-A1 SUBSTITUTED BENZOTHIENOPYRIMIDINES Bayer Pharma Aktiengesellschaft (DE) 2015-04-01 EP disclosed
WO-2015004024-A1 SUBSTITUTED PYRAZOLO-PYRIDINAMINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-01-15 WO disclosed
WO-2013174735-A1 SUBSTITUTED BENZOTHIENOPYRIMIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2013-11-28 WO disclosed
WO-2013174744-A1 THIENOPYRIMIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2013-11-28 WO 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 (4 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 MKNK1 1/4885LIMK1 287/4885P2RX3 907/4885
US-20150152121-A1 Substituted Benzothienopyrimidines CCNA1, CCNT2, TYMP MKNK1 4342/4885LIMK1 4038/4885P2RX3 743/4885
US-20150133425-A1 THIENOPYRIMIDINES TYMP, DPYD, TYMS MKNK1 2721/4885LIMK1 3711/4885P2RX3 667/4885
US-20160159789-A1 SUBSTITUTED PYRAZOLOPYRIDINES DPYD, PGF, VEGFA MKNK1 2345/4885LIMK1 2545/4885P2RX3 560/4885

“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.