SCHEMBL1427192

SCHEMBL1427192

O=C(Cc1cccc(-c2ncc(OCCN3CCOCC3)cn2)c1)N1CCC(c2cc(Cl)ccc2Cl)=N1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 3/20 0.65
▸ TSHR P16473 2/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ TP53 P04637 1/20 0.45
▸ KDR P35968 2/20 0.40
▸ ROCK1 Q13464 2/20 0.39
▸ ROCK2 O75116 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ EPHX2 P34913 2/20 0.39
▸ SRC P12931 2/20 0.39
▸ AURKB Q96GD4 4/20 0.38
▸ GLS O94925 1/20 0.38
▸ ABL1 P00519 1/20 0.38
▸ TUBB4A P04350 1/20 0.38
▸ TUBB P07437 1/20 0.38
▸ LYN P07948 1/20 0.38
▸ TUBA3C P0DPH7 1/20 0.38
▸ BCR P11274 1/20 0.38
▸ TUBA1B P68363 1/20 0.38
▸ TUBA4A P68366 1/20 0.38

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
SCHEMBL1427063 0.83 MET (0.53) METALDH1A1
SCHEMBL1427146 0.83 MET (0.49) METKDRALDH1A1
SCHEMBL1427084 0.82 MET (0.52) METALDH1A1
SCHEMBL1427643 0.80 MET (0.51) METKDRAURKB
SCHEMBL1464337 0.80 MET (0.49) METTSHRALDH1A1
SCHEMBL12922931 0.79 MET (1.00) METKDRALDH1A1EPHX2
SCHEMBL12747571 0.78 MET (0.48) METKDRALDH1A1
SCHEMBL12747569 0.77 MET (0.44) METTP53
SCHEMBL982217 0.76 MET (0.67) METTSHRKDM4EALDH1A1EPHX2
SCHEMBL1427614 0.75 MET (0.54) METTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2300434-B1 DIHYDROPYRAZOLE DERIVATIVES AS TYROSINE KINASE MODULATORS FOR THE TREATMENT OF TUMORS MERCK PATENT GMBH (DE) 2014-07-23 — — EP claimed
US-8404685-B2 Dihydropyrazole derivatives as tyrosine kinase modulators for the treatment of tumors MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-03-26 — — US claimed
US-20110071153-A1 DIHYDROPYRAZOLE DERIVATIVES AS TYROSINE KINASE MODULATORS FOR THE TREATMENT OF TUMORS MERCK PATENT GESELLSCHAFT (DE) 2011-03-24 — — US claimed
EP-2300434-B1 DIHYDROPYRAZOLE DERIVATIVES AS TYROSINE KINASE MODULATORS FOR THE TREATMENT OF TUMORS MERCK PATENT GMBH (DE) 2014-07-23 — — EP disclosed
EP-2300434-B1 DIHYDROPYRAZOLE DERIVATIVES AS TYROSINE KINASE MODULATORS FOR THE TREATMENT OF TUMORS MERCK PATENT GMBH (DE) 2014-07-23 — — EP disclosed
US-8404685-B2 Dihydropyrazole derivatives as tyrosine kinase modulators for the treatment of tumors MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-03-26 — — US disclosed
US-8404685-B2 Dihydropyrazole derivatives as tyrosine kinase modulators for the treatment of tumors MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-03-26 — — US disclosed
US-8404685-B2 Dihydropyrazole derivatives as tyrosine kinase modulators for the treatment of tumors MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-03-26 — — US disclosed
EP-2300434-A1 DIHYDROPYRAZOLE DERIVATIVES AS TYROSINE KINASE MODULATORS FOR THE TREATMENT OF TUMORS Merck Patent GmbH (DE) 2011-03-30 — — EP disclosed
US-20110071153-A1 DIHYDROPYRAZOLE DERIVATIVES AS TYROSINE KINASE MODULATORS FOR THE TREATMENT OF TUMORS MERCK PATENT GESELLSCHAFT (DE) 2011-03-24 — — US disclosed
US-20110071153-A1 DIHYDROPYRAZOLE DERIVATIVES AS TYROSINE KINASE MODULATORS FOR THE TREATMENT OF TUMORS MERCK PATENT GESELLSCHAFT (DE) 2011-03-24 — — US disclosed
US-20110071153-A1 DIHYDROPYRAZOLE DERIVATIVES AS TYROSINE KINASE MODULATORS FOR THE TREATMENT OF TUMORS MERCK PATENT GESELLSCHAFT (DE) 2011-03-24 — — US disclosed
WO-2009143945-A1 DIHYDROPYRAZOLE DERIVATIVES AS TYROSINE KINASE MODULATORS FOR THE TREATMENT OF TUMORS MERCK PATENT GMBH, (DE) 2009-12-03 — — WO disclosed
WO-2009143945-A1 DIHYDROPYRAZOLE DERIVATIVES AS TYROSINE KINASE MODULATORS FOR THE TREATMENT OF TUMORS MERCK PATENT GMBH, (DE) 2009-12-03 — — 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-20110071153-A1 DIHYDROPYRAZOLE DERIVATIVES AS TYROSINE KINASE MODULATORS FOR THE TREATMENT OF TUMORS RET, FLT3, TYRO3 MET 4/4885TSHR 546/4885KDM4E 1066/4885

“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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