SCHEMBL5260788

SCHEMBL5260788

N#Cc1ccccc1Nc1ccnc(Cl)n1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 4/20 0.64
▸ EPHB4 P54760 1/20 0.50
▸ IRAK4 Q9NWZ3 1/20 0.46
▸ CDK4 P11802 1/20 0.44
▸ CDK2 P24941 1/20 0.44
▸ SYK P43405 1/20 0.43
▸ FLT1 P17948 1/20 0.42
▸ FLT4 P35916 1/20 0.42
▸ KDR P35968 1/20 0.42
▸ ABCG2 Q9UNQ0 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ PIN1 Q13526 1/20 0.38
▸ EGFR P00533 1/20 0.38
▸ LRRK2 Q5S007 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 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
SCHEMBL34462756 1.00 AURKA (0.64) AURKAEPHB4IRAK4CDK4CDK2
SCHEMBL15492037 0.79 AURKA (0.53) AURKAEPHB4SYKKMT2ATSHR
SCHEMBL27897793 0.79 AURKA (0.64) AURKAEPHB4IRAK4CDK4CDK2
SCHEMBL15489512 0.76 MAPK10 (0.57) EPHB4CDK2SYKEGFRLRRK2
SCHEMBL15489626 0.76 AURKA (0.51) AURKACDK2SYKMEN1MAPT
SCHEMBL18386772 0.76 MAPK8 (0.55) AURKASYKMEN1MAPTKMT2A
SCHEMBL12813310 0.76 AURKA (0.61) AURKAEPHB4CDK4CDK2SYK
SCHEMBL15489547 0.76 AURKA (0.51) AURKACDK4CDK2SYKMEN1
SCHEMBL18387036 0.76 MAPK10 (0.57) AURKASYKMEN1MAPTKMT2A
SCHEMBL3947897 0.76 MEN1 (0.66) AURKAIRAK4FLT1FLT4KDR

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
US-9597329-B2 Aurora kinase inhibitors and methods of making and using thereof H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC (US) 2017-03-21 — — US disclosed
US-20170000787-A1 AURORA KINASE INHIBITORS AND METHODS OF MAKING AND USING THEREOF H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2017-01-05 — — US disclosed
US-9249124-B2 Aurora kinase inhibitors and methods of making and using thereof H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2016-02-02 — — US disclosed
US-20140057913-A1 AURORA KINASE INHIBITORS AND METHODS OF MAKING AND USING THEREOF H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2014-02-27 — — US disclosed
EP-1272477-B1 PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2007-05-09 — — EP disclosed
US-7176212-B2 2,4-diamino pyrimidine compounds having anti-cell proliferative activity ASTRAZENECA AB (SE) 2007-02-13 — — US disclosed
US-7153964-B2 Pyrimidine compounds ASTRAZENECA AB (SE) 2006-12-26 — — US disclosed
EP-1107957-B1 PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2006-10-18 — — EP disclosed
US-20050090493-A1 2,4-Diamino pyrimidine compounds having anti-cell proliferative activity ASTRAZENECA AB 2005-04-28 — — US disclosed
US-20030149064-A1 Pyrimidine compounds ASTRAZENECA AB (SE) 2003-08-07 — — US disclosed
EP-1272477-A1 PYRIMIDINE COMPOUNDS AstraZeneca AB (SE) 2003-01-08 — — EP disclosed
WO-2001064654-A1 PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2001-09-07 — — WO disclosed
EP-1107957-A1 PYRIMIDINE COMPOUNDS AstraZeneca AB (SE) 2001-06-20 — — EP disclosed
WO-2000012485-A1 PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2000-03-09 — — 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-20140057913-A1 AURORA KINASE INHIBITORS AND METHODS OF MAKING AND USING THEREOF AURKC, AURKA, AURKB AURKA 2/4885EPHB4 1755/4885IRAK4 1113/4885
US-20050090493-A1 2,4-Diamino pyrimidine compounds having anti-cell proliferative activity H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, H1-3, H1-0 AURKA 345/4885EPHB4 3658/4885IRAK4 4711/4885
US-20030149064-A1 Pyrimidine compounds CDK2, CCNI, CCNY AURKA 72/4885EPHB4 3797/4885IRAK4 2870/4885
US-20170000787-A1 AURORA KINASE INHIBITORS AND METHODS OF MAKING AND USING THEREOF AURKC, AURKA, AURKB AURKA 2/4885EPHB4 1755/4885IRAK4 1113/4885

“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.

Send feedback