SCHEMBL16741386

SCHEMBL16741386

CN(C)C1CCN(c2cc3[nH]ncc3cc2N)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHEK1 O14757 1/20 0.46
▸ JAK2 O60674 1/20 0.41
▸ JAK1 P23458 1/20 0.41
▸ TIPARP Q7Z3E1 1/20 0.38
▸ PTPN11 Q06124 1/20 0.35
▸ ROCK2 O75116 6/20 0.35
▸ ROCK1 Q13464 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ PKM P14618 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ HRH4 Q9H3N8 1/20 0.33

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
SCHEMBL16741472 0.81 CHEK1 (0.58) CHEK1ROCK2ROCK1KDM4EMEN1
SCHEMBL16741279 0.81 CHEK1 (0.58) CHEK1ROCK2ROCK1KDM4EMEN1
SCHEMBL16741400 0.80 MEN1 (0.43) JAK2JAK1TIPARPMEN1MAPT
SCHEMBL15586058 0.69 ALDH1A1 (0.50) KDM4EMEN1MAPTKMT2AHTT
SCHEMBL28087914 0.69 CCR4 (0.40) KDM4EMEN1MAPTKMT2AALDH1A1
SCHEMBL17373939 0.69 CHEK1 (0.40) CHEK1JAK2JAK1ROCK2ROCK1
SCHEMBL17373940 0.69 CHEK1 (0.40) CHEK1JAK2JAK1ROCK2ROCK1
SCHEMBL29748984 0.68 GAA (0.43) KDM4EMEN1MAPTKMT2AHTT
SCHEMBL4434929 0.67 MAPT (0.52) TIPARPPTPN11ROCK2ROCK1MEN1
SCHEMBL16803413 0.67 DRD2 (0.44) PTPN11KDM4EMEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106061980-A Thienopyrimidines as MKNK1 and MKNK2 Inhibitors 拜耳制药股份公司 2016-10-26 — — CN disclosed
US-20160297833-A1 THIENOPYRIMIDINES AS MKNK1 AND MKNK2 INHIBITORS Bayer Pharma AG (DE) 2016-10-13 — — US disclosed
EP-3071577-A1 THIENOPYRIMIDINES AS MKNK1 AND MKNK2 INHIBITORS Bayer Pharma Aktiengesellschaft (DE) 2016-09-28 — — EP disclosed
WO-2015074986-A1 THIENOPYRIMIDINES AS MKNK1 AND MKNK2 INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-05-28 — — WO disclosed
WO-2015074986-A1 THIENOPYRIMIDINES AS MKNK1 AND MKNK2 INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-05-28 — — 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 (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-20160297833-A1 THIENOPYRIMIDINES AS MKNK1 AND MKNK2 INHIBITORS MKNK1, MKNK2, DTYMK CHEK1 200/4885JAK2 591/4885JAK1 434/4885

“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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