SCHEMBL1584889

SCHEMBL1584889

O=c1nc[nH]c2ccc(Br)cc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 4/20 0.56
▸ FLT3 P36888 3/20 0.56
▸ CHEK1 O14757 2/20 0.56
▸ PIM3 Q86V86 2/20 0.56
▸ AKT1 P31749 1/20 0.56
▸ CDK5 Q00535 3/20 0.48
▸ JAK2 O60674 2/20 0.48
▸ PRKACA P17612 2/20 0.48
▸ CSNK1A1 P48729 2/20 0.48
▸ GSK3B P49841 2/20 0.48
▸ PRKD3 O94806 2/20 0.48
▸ MAP4K4 O95819 2/20 0.48
▸ CSF1R P07333 2/20 0.48
▸ CLK2 P49760 2/20 0.48
▸ MAP4K2 Q12851 2/20 0.48
▸ DYRK1A Q13627 2/20 0.48
▸ NTRK3 Q16288 2/20 0.48
▸ AURKB Q96GD4 2/20 0.48
▸ CLK4 Q9HAZ1 2/20 0.48
▸ AURKA O14965 1/20 0.48

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
SCHEMBL12489082 0.85 PIM1 (0.51) PIM1FLT3CHEK1PIM3AKT1
SCHEMBL8622177 0.81 ACVR1 (0.46) PIM1FLT3CHEK1PIM3AKT1
SCHEMBL216175 0.79 PARP1 (0.54) PIM1FLT3CHEK1PIM3AKT1
SCHEMBL2191063 0.79 PARP1 (0.54) CHEK1GPR84HTR2ATRPM8IDO1
SCHEMBL2574527 0.79 LMNA (0.57) HPGDLMNAHTR2ACYP1A2MEN1
SCHEMBL1507612 0.79 PARP1 (0.54) PIM1CHEK1RPS6KA3HPGDLMNA
SCHEMBL8700858 0.79 PARP1 (0.54) RPS6KA3CSNK2A1HPGDCLK1ALDH1A1
SCHEMBL2191001 0.79 PARP1 (0.54) PIM1FLT3CHEK1PIM3JAK2
SCHEMBL9514887 0.77 IP6K1 (0.41) PIM1FLT3CHEK1PIM3AKT1
SCHEMBL5105611 0.77 KIF11 (0.45) PIM1FLT3CHEK1PIM3AKT1

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240294524-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2024-09-05 — — US disclosed
CN-114746405-B Novel BRAF inhibitors as anomalous breakers 豪夫迈·罗氏有限公司 2024-03-26 — — CN disclosed
EP-3466929-B1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS MILLENNIUM PHARM INC (US) 2023-09-06 — — EP disclosed
US-20230113598-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS BIOGEN IDEC MA INC. 2023-04-13 — — US disclosed
CN-114746405-A Novel BRAF inhibitors as paradoxical breakers 豪夫迈·罗氏有限公司 2022-07-12 — — CN disclosed
WO-2021116050-A1 NEW BRAF INHIBITORS AS PARADOX BREAKERS F. HOFFMANN-LA ROCHE AG (CH) 2021-06-17 — — WO disclosed
US-20210070752-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS VIRACTA THERAPEUTICS, INC. 2021-03-11 — — US disclosed
CN-107337646-B Method for synthesizing quinazolinone derivative by using methanol as raw material 南京理工大学 2020-04-07 — — CN disclosed
US-20190119268-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS SUNESIS PHARMACEUTICALS, INC. 2019-04-25 — — US disclosed
EP-3466929-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS Millennium Pharmaceuticals, Inc. (US) 2019-04-10 — — EP disclosed
EP-2538787-A1 TRIAZOLONES AS FATTY ACID SYNTHASE INHIBITORS GlaxoSmithKline LLC (US) 2013-01-02 — — EP disclosed
US-20120316151-A1 TRIAZOLONES AS FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC 2012-12-13 — — US disclosed
US-20120208819-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2012-08-16 — — US disclosed
EP-2485731-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS Millennium Pharmaceuticals, Inc. (US) 2012-08-15 — — EP disclosed
WO-2011103546-A1 TRIAZOLONES AS FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2011-08-25 — — WO disclosed
WO-2011044157-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS BIOGEN IDEC MA INC. (US) 2011-04-14 — — WO disclosed
WO-2010020366-A1 AZABICYCLIC SUBSTITUTED 5-AMINOPYRAZOLES AND THE USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-02-25 — — WO disclosed
WO-2009102694-A1 HETEROCYCLIC DERIVATIVES AS HEPATITIS C VIRUS INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-08-20 — — WO disclosed
EP-0520722-B1 Therapeutic preparations containing quinazoline derivatives ZENECA LTD (GB) 1996-12-27 — — EP disclosed
EP-0520722-A1 Therapeutic preparations containing quinazoline derivatives ZENECA LIMITED (GB) 1992-12-30 — — 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 (6 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-20120208819-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS PDK1, PDK2, PDK3 PIM1 104/4885FLT3 1203/4885CHEK1 420/4885
US-20240294524-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS PDK1, PDK2, PDK3 PIM1 104/4885FLT3 1203/4885CHEK1 420/4885
US-20120316151-A1 TRIAZOLONES AS FATTY ACID SYNTHASE INHIBITORS FASN, FADS1, FADS2 PIM1 1731/4885FLT3 555/4885CHEK1 1396/4885
US-20210070752-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS PDK1, PDK2, PDK3 PIM1 104/4885FLT3 1203/4885CHEK1 420/4885
US-20190119268-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS PDK1, PDK2, PDK3 PIM1 104/4885FLT3 1203/4885CHEK1 420/4885
US-20230113598-A1 HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS PDK1, PDK2, PDK3 PIM1 104/4885FLT3 1203/4885CHEK1 420/4885

“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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