SCHEMBL1507614

SCHEMBL1507614

Cc1ccc2nc[nH]c(=O)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 10/20 1.00
CHEK1 O14757 2/20 0.74
PIM1 P11309 2/20 0.74
RPS6KA3 P51812 1/20 0.74
AKT1 P31749 1/20 0.64
FLT3 P36888 1/20 0.64
PIM3 Q86V86 1/20 0.64
IP6K1 Q92551 6/20 0.63
SLC2A1 P11166 1/20 0.61
PDPK1 O15530 1/20 0.56
CA12 O43570 1/20 0.56
ALOX15 P16050 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
CA9 Q16790 1/20 0.56
TNKS2 Q9H2K2 1/20 0.56
ACVR1 Q04771 2/20 0.56
IP6K3 Q96PC2 5/20 0.54
IP6K2 Q9UHH9 3/20 0.54

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
SCHEMBL29605527 1.00 PARP1 (1.00) PARP1CHEK1PIM1RPS6KA3AKT1
SCHEMBL13820309 0.88 PARP1 (0.78) PARP1CHEK1PIM1RPS6KA3AKT1
SCHEMBL1690531 0.85 PARP1 (1.00) PARP1CHEK1PIM1RPS6KA3AKT1
SCHEMBL29967230 0.85 PARP1 (1.00) PARP1CHEK1PIM1RPS6KA3AKT1
SCHEMBL17586152 0.82 PARP1 (0.70) PARP1CHEK1PIM1RPS6KA3AKT1
SCHEMBL8622180 0.81 ACVR1 (0.73) PARP1CHEK1PIM1AKT1FLT3
SCHEMBL3742786 0.79 ACVR1 (0.65) PARP1CHEK1PIM1RPS6KA3AKT1
SCHEMBL642178 0.78 PARP1 (1.00) PARP1CHEK1PIM1AKT1FLT3
SCHEMBL2081677 0.78 PARP1 (1.00) PARP1CHEK1PIM1AKT1FLT3
SCHEMBL2191067 0.78 PARP1 (1.00) PARP1CHEK1PIM1AKT1FLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101857617-A Quinazoline sugar derivative and preparation method and application thereof OCEAN UNIV CHINA 2010-10-13 CN claimed
CN-117946012-A Preparation method of nitrogen-containing heterocycle 温州理工学院 2024-04-30 CN disclosed
US-20240034723-A1 PIPERIDINYL SMALL MOLECULE DEGRADERS OF HELIOS AND METHODS OF USE DANA-FARBER CANCER INSTITUTE, INC. (US) 2024-02-01 US disclosed
CN-114807987-B Electrochemical method for preparing fused polycyclic quinazolinone derivative 哈尔滨工业大学(深圳) 2023-10-03 CN disclosed
CN-116669769-A Piperidinyl small molecule degradants of HELIOS and methods of use 达纳-法伯癌症研究所公司 2023-08-29 CN disclosed
CN-114621194-B 4-methylene-N-hydroxybenzoamide compound and application thereof 沈阳药科大学 2023-08-29 CN disclosed
EP-4228651-A1 PIPERIDINYL SMALL MOLECULE DEGRADERS OF HELIOS AND METHODS OF USE Dana-Farber Cancer Institute, Inc. (US) 2023-08-23 EP disclosed
US-20230140216-A1 COMBINATION THERAPY FOR TREATING MPS1 GAIN THERAPEUTICS SA (CH) 2023-05-04 US disclosed
CN-113637011-B Myricetin derivative containing quinazoline-4 (3H) -ketone and preparation method and application thereof 贵州大学 2023-03-31 CN disclosed
WO-2023274246-A1 AMIDE COMPOUND AND USE THEREOF 成都分迪药业有限公司 2023-01-05 WO disclosed
CN-1137037-A Quinazoline derivatives PFIZER (US) 1996-12-04 CN disclosed
WO-1996030347-A1 QUINAZOLINE DERIVATIVES PFIZER INC. (US) 1996-10-03 WO disclosed
EP-0566226-B1 Quinazoline derivatives ZENECA LTD (GB) 1995-11-08 EP disclosed
US-5457105-A anticancer use; e.g. 4-(3'-chloro-4'-fluoroanilino)-6,7-dimethoxyquinazoline (gefitinib) ZENECA LIMITED (GB) 1995-10-10 US disclosed
WO-1995024190-A2 RECEPTOR TYROSINE KINASE INHIBITORS FOR INHIBITING CELL PROLIFERATIVE DISORDERS AND COMPOSITIONS THEREOF SUGEN, INC. (US) 1995-09-14 WO disclosed
EP-0566226-A1 Quinazoline derivatives ZENECA LIMITED (GB) 1993-10-20 EP disclosed
US-5236927-A Reduced toxicity; side effect reduction NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1993-08-17 US disclosed
EP-0204529-B1 ANTI-CANCER QUINAZOLINE DERIVATIVES BTG INTERNATIONAL LIMITED (GB) 1993-03-31 EP disclosed
EP-0204529-A2 Anti-cancer quinazoline derivatives BTG INTERNATIONAL LIMITED (GB) 1986-12-10 EP disclosed
US-4223143-A PYRAZOLO-QUINAZOLIN-ONES, CONTROLLING URIC ACID CONCENTRATION, GOUT, XANTHINE OXIDASE SIEGFRIED AKTIENGESELLSCHAFT (CH) 1980-09-16 US 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 (2 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-20230140216-A1 COMBINATION THERAPY FOR TREATING MPS1 IDUA, MAN2B1, GBA1 PARP1 3379/4885CHEK1 4632/4885PIM1 1672/4885
US-20240034723-A1 PIPERIDINYL SMALL MOLECULE DEGRADERS OF HELIOS AND METHODS OF USE IKZF2, IKZF1, NUTF2 PARP1 1121/4885CHEK1 3435/4885PIM1 3803/4885

“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.