SCHEMBL2191067

SCHEMBL2191067

O=c1[nH]cnc2ccc(F)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 8/20 1.00
IP6K1 Q92551 8/20 0.69
IP6K3 Q96PC2 5/20 0.69
CHEK1 O14757 1/20 0.64
PIM1 P11309 1/20 0.64
AKT1 P31749 1/20 0.64
FLT3 P36888 1/20 0.64
PIM3 Q86V86 1/20 0.64
SLC2A1 P11166 1/20 0.57
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
IP6K2 Q9UHH9 3/20 0.54
ACVR1 Q04771 1/20 0.53
ALDH1A1 P00352 1/20 0.50

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
SCHEMBL29709603 1.00 PARP1 (1.00) PARP1IP6K1IP6K3CHEK1PIM1
Hydrochloric Acid SCHEMBL30141968 0.98 PARP1 (0.96) PARP1IP6K1IP6K3CHEK1PIM1
SCHEMBL24819 0.85 PARP1 (0.74) PARP1IP6K1IP6K3CHEK1PIM1
SCHEMBL29967106 0.85 PARP1 (0.74) PARP1IP6K1IP6K3CHEK1PIM1
Ethoxycarbonyl Group SCHEMBL27845957 0.83 PARP1 (0.69) PARP1IP6K1IP6K3CHEK1PIM1
SCHEMBL8622180 0.81 ACVR1 (0.73) PARP1IP6K1IP6K3CHEK1PIM1
SCHEMBL9263181 0.78 PARP1 (0.64) PARP1IP6K1IP6K3CHEK1PIM1
SCHEMBL642178 0.78 PARP1 (1.00) PARP1IP6K1IP6K3CHEK1PIM1
SCHEMBL2081677 0.78 PARP1 (1.00) PARP1IP6K1IP6K3CHEK1PIM1
SCHEMBL216176 0.78 PARP1 (1.00) PARP1IP6K1IP6K3CHEK1PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025024663-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2025-01-30 WO claimed
EP-4326273-A1 QUINAZOLINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC USES RELATED TO NOX INHIBITION Emory University (US) 2024-02-28 EP claimed
WO-2022200523-A9 PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 19 (USP19) ALMAC DISCOVERY LIMITED (GB) 2023-02-16 WO claimed
EP-3728207-B1 QUINAZOLINONES AS PARP14 INHIBITORS RIBON THERAPEUTICS INC (US) 2023-02-01 EP claimed
WO-2022225866-A1 QUINAZOLINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC USES RELATED TO NOX INHIBITION EMORY UNIVERSITY (US) 2022-10-27 WO claimed
US-12459922-B2 PARP7 inhibitors GILEAD SCIENCES, INC. (US) 2025-11-04 US disclosed
WO-2025024663-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2025-01-30 WO disclosed
US-20240327382-A1 PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 19 ALMAC DISCOVERY LIMITED (GB) 2024-10-03 US disclosed
EP-4326273-A1 QUINAZOLINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC USES RELATED TO NOX INHIBITION Emory University (US) 2024-02-28 EP disclosed
EP-4313295-A1 PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 19 (USP19) Almac Discovery Limited (GB) 2024-02-07 EP disclosed
CN-117466942-A Chiral secondary phosphine oxide compound, chiral quinazolinone/pyrimidinone ring derivative based on chiral secondary phosphine oxide compound and application of chiral quinazolinone/pyrimidinone ring derivative 中山大学 2024-01-30 CN disclosed
CN-117157285-A Pharmaceutical compounds as ubiquitin-specific protease 19 (USP 19) inhibitors 阿尔麦克探索有限公司 2023-12-01 CN disclosed
EP-0794953-B1 QUINAZOLINE DERIVATIVES ZENECA LTD (GB) 1999-05-06 EP disclosed
EP-0794953-A1 QUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1997-09-17 EP disclosed
US-5580870-A ANTICARCINOGENIC AGENTS ZENECA LIMITED (GB) 1996-12-03 US disclosed
EP-0602851-B1 Quinazoline derivatives ZENECA LTD (GB) 1996-10-09 EP disclosed
WO-1996016960-A1 QUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1996-06-06 WO disclosed
US-5387585-A Treating epilepsy, anxiety, sleep disorders, schizophrnia, senile dementia HOFFMANN-LA ROCHE INC. (US) 1995-02-07 US disclosed
EP-0602851-A1 Quinazoline derivatives ZENECA LIMITED (GB) 1994-06-22 EP disclosed
EP-0519307-A2 Tetracyclic Imidazodiazepines F. HOFFMANN-LA ROCHE AG (CH) 1992-12-23 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 (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-20240327382-A1 PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 19 USP19, USP18, UBE2I PARP1 1106/4885IP6K1 3487/4885IP6K3 3564/4885
US-12459922-B2 PARP7 inhibitors PARP1, PARP11, PARP2 PARP1 1/4885IP6K1 1522/4885IP6K3 909/4885

“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.