SCHEMBL3052816

SCHEMBL3052816

Fc1ccc(-c2cccc3c(-c4ccnc(Nc5ccc(N6CCOCC6)cc5)n4)c[nH]c23)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 10/20 0.56
▸ KCNH2 Q12809 1/20 0.54
▸ PLK4 O00444 4/20 0.52
▸ FLT3 P36888 2/20 0.51
▸ CDK1 P06493 1/20 0.51
▸ CCNB1 P14635 1/20 0.51
▸ CCNE1 P24864 1/20 0.51
▸ CDK2 P24941 1/20 0.51
▸ JAK3 P52333 3/20 0.51
▸ JAK1 P23458 2/20 0.51
▸ TYK2 P29597 2/20 0.51
▸ MAPK8 P45983 1/20 0.50
▸ MAPK10 P53779 1/20 0.50
▸ EGFR P00533 1/20 0.49

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
SCHEMBL3043740 0.88 JAK2 (0.58) JAK2PLK4FLT3CDK1CCNB1
SCHEMBL3044992 0.82 JAK2 (0.55) JAK2KCNH2PLK4FLT3CDK1
SCHEMBL3050088 0.81 CDK1 (0.73) JAK2FLT3CDK1CCNB1CCNE1
SCHEMBL3052529 0.81 JAK2 (0.58) JAK2KCNH2PLK4FLT3CDK1
SCHEMBL3049599 0.81 JAK2 (0.60) JAK2KCNH2PLK4FLT3CDK1
SCHEMBL4385729 0.81 JAK2 (0.78) JAK2KCNH2PLK4JAK3JAK1
SCHEMBL3052850 0.81 FLT3 (0.73) JAK2PLK4FLT3CDK1CCNB1
SCHEMBL3050025 0.79 JAK2 (0.57) JAK2PLK4FLT3CDK1CCNE1
SCHEMBL3048118 0.78 JAK2 (0.58) JAK2PLK4FLT3CDK2JAK3
SCHEMBL12274649 0.77 JAK2 (0.77) JAK2PLK4JAK3JAK1TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100267707-A1 Tyrosine Kinase Inhibitors MERCK SHARP & DOHME CORP. (US) 2010-10-21 — — US claimed
EP-2040546-A2 TYROSINE KINASE INHIBITORS Merck & Co., Inc. (US) 2009-04-01 — — EP claimed
WO-2007149427-A2 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2007-12-27 — — WO claimed
US-20100267707-A1 Tyrosine Kinase Inhibitors MERCK SHARP & DOHME CORP. (US) 2010-10-21 — — US disclosed
US-20100267707-A1 Tyrosine Kinase Inhibitors MERCK SHARP & DOHME CORP. (US) 2010-10-21 — — US disclosed
US-20100267707-A1 Tyrosine Kinase Inhibitors MERCK SHARP & DOHME CORP. (US) 2010-10-21 — — US disclosed
EP-2040546-A2 TYROSINE KINASE INHIBITORS Merck & Co., Inc. (US) 2009-04-01 — — EP disclosed
WO-2007149427-A2 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2007-12-27 — — WO disclosed
WO-2007149427-A2 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2007-12-27 — — 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-20100267707-A1 Tyrosine Kinase Inhibitors ABL1, ERBB2, MET JAK2 16/4885KCNH2 4203/4885PLK4 417/4885

“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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