SCHEMBL16963656

SCHEMBL16963656

CN1CCN(C(=O)c2cc3c(Nc4ccc5[nH]ncc5c4)ncnc3[nH]2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 4/20 0.58
▸ PDGFRB P09619 2/20 0.52
▸ PDGFRA P16234 2/20 0.52
▸ ROCK2 O75116 4/20 0.51
▸ EGFR P00533 3/20 0.50
▸ RET P07949 2/20 0.48
▸ SYK P43405 2/20 0.47
▸ ROCK1 Q13464 2/20 0.47
▸ CHEK1 O14757 1/20 0.47
▸ AURKA O14965 1/20 0.47
▸ DAPK3 O43293 1/20 0.47
▸ JAK2 O60674 1/20 0.47
▸ PRKD3 O94806 1/20 0.47
▸ MAP4K4 O95819 1/20 0.47
▸ PAK4 O96013 1/20 0.47
▸ ABL1 P00519 1/20 0.47
▸ NTRK1 P04629 1/20 0.47
▸ LCK P06239 1/20 0.47
▸ FYN P06241 1/20 0.47
▸ CSF1R P07333 1/20 0.47

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
SCHEMBL16963547 0.92 MKNK1 (0.62) MKNK1ROCK2EGFRRETROCK1
SCHEMBL16963619 0.91 MKNK1 (0.48) MKNK1PDGFRBPDGFRAROCK2EGFR
SCHEMBL16962040 0.82 MKNK1 (0.67) MKNK1ROCK2EGFRRETSYK
SCHEMBL16963088 0.81 MKNK1 (0.61) MKNK1ROCK2EGFRRETSYK
SCHEMBL16963343 0.80 MKNK1 (0.65) MKNK1ROCK2EGFRRETSYK
SCHEMBL4352904 0.79 TTBK1 (0.51) EGFRABL1HRH4HRH3
SCHEMBL16963123 0.79 MKNK1 (0.58) MKNK1EGFRRETJAK2JAK3
SCHEMBL16371340 0.77 MKNK1 (0.45) MKNK1ROCK2EGFRROCK1DYRK1A
SCHEMBL16963653 0.77 MKNK1 (0.56) MKNK1EGFRRET
SCHEMBL16371910 0.77 MKNK1 (0.47) MKNK1ROCK2SYKROCK1DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150218173-A1 SUBSTITUTED INDAZOL-PYRROLOPYRIMIDINES USEFUL IN THE TREATMENT OF HYPERFOLIFERATIVE DISORDERS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-08-06 — — US disclosed
US-20150218173-A1 SUBSTITUTED INDAZOL-PYRROLOPYRIMIDINES USEFUL IN THE TREATMENT OF HYPERFOLIFERATIVE DISORDERS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-08-06 — — US disclosed
EP-2900670-A1 SUBSTITUTED INDAZOL-PYRROLOPYRIMIDINES USEFUL IN THE TREATMENT OF HYPERFOLIFERATIVE DISORDERS Bayer Pharma Aktiengesellschaft (DE) 2015-08-05 — — EP 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-20150218173-A1 SUBSTITUTED INDAZOL-PYRROLOPYRIMIDINES USEFUL IN THE TREATMENT OF HYPERFOLIFERATIVE DISORDERS CCND2, ARG2, ARG1 MKNK1 2957/4885PDGFRB 154/4885PDGFRA 200/4885

“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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