SCHEMBL857761

SCHEMBL857761

FC(F)(F)c1ccc2c(Cl)ncnc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.49
PDE4A P27815 1/20 0.48
PDE4B Q07343 1/20 0.48
PDE4C Q08493 1/20 0.48
PDE4D Q08499 1/20 0.48
EGFR P00533 7/20 0.43
ADRB2 P07550 1/20 0.41
NCF1 P14598 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.39
MAOB P27338 1/20 0.39
KDM4E B2RXH2 1/20 0.39
CNR1 P21554 1/20 0.39
SCN9A Q15858 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.38
SAE1 Q9UBE0 1/20 0.38
UBA2 Q9UBT2 1/20 0.38
LPAR2 Q9HBW0 1/20 0.38
RAB9A P51151 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
SCHEMBL29416609 1.00 PARP1 (0.49) PARP1PDE4APDE4BPDE4CPDE4D
SCHEMBL22749367 0.86 PDE4A (0.46) PARP1PDE4APDE4BPDE4CPDE4D
SCHEMBL686704 0.86 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DEGFR
SCHEMBL27461883 0.79 PARP1 (0.49) PARP1EGFRADRB2NCF1ABCG2
SCHEMBL26313476 0.79 PARP1 (0.49) PARP1EGFRADRB2NCF1ABCG2
SCHEMBL26090047 0.79 PARP1 (0.49) PARP1EGFRADRB2NCF1ABCG2
SCHEMBL8809376 0.79 PARP1 (0.49) PARP1EGFRADRB2NCF1ABCG2
SCHEMBL29461277 0.76 PDE4A (0.53) PDE4APDE4BPDE4CPDE4DEGFR
SCHEMBL856547 0.76 PDE4A (0.53) PDE4APDE4BPDE4CPDE4DEGFR
SCHEMBL29878151 0.75 ADRB2 (0.51) PARP1ADRB2NCF1MAOBSCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12390463-B2 Dosage forms and regimens for amino acid compounds PLIANT THERAPEUTICS, INC. (US) 2025-08-19 US disclosed
US-20250223288-A1 AMINO ACID COMPOUNDS AND METHODS OF USE PLIANT THERAPEUTICS, INC. 2025-07-10 US disclosed
WO-2025067384-A1 AMINO ACID INTEGRIN INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF 成都微芯药业有限公司 2025-04-03 WO disclosed
EP-4520329-A2 TREATMENT OF RESPIRATORY DISEASES WITH AMINO ACID COMPOUNDS Pliant Therapeutics, Inc. (US) 2025-03-12 EP disclosed
EP-4509512-A2 AMINO ACID COMPOUNDS AND METHODS OF USE Pliant Therapeutics, Inc. (US) 2025-02-19 EP disclosed
CN-117986260-A Spiro compound, preparation method and application thereof 中国科学院上海药物研究所 2024-05-07 CN disclosed
EP-4329755-A1 EXPANDED DOSAGE REGIMENS FOR INTEGRIN INHIBITORS Pliant Therapeutics, Inc. (US) 2024-03-06 EP disclosed
EP-4328230-A2 AMINO ACID COMPOUNDS AND METHODS OF USE Pliant Therapeutics, Inc. (US) 2024-02-28 EP disclosed
CN-117615760-A Extended dosage regimen for integrin inhibitors 普利安特治疗公司 2024-02-27 CN disclosed
EP-3761980-B1 AMINO ACID COMPOUNDS AND METHODS OF USE PLIANT THERAPEUTICS INC (US) 2023-11-29 EP disclosed
US-20100298290-A1 Benzoxazepines as Inhibitors of PI3K/mTOR and Methods of Their Use and Manufacture EXELIXIS, INC. (US) 2010-11-25 US disclosed
WO-2010135524-A1 BENZOXAZEPINES BASED P13K/MT0R INHIBITORS AGAINST PROLIFERATIVE DISEASES EXELIXIS, INC. (US) 2010-11-25 WO disclosed
CN-101341133-A Quinazoline derivatives, process for their preparation and their use as anti-cancer agents ASTRAZENECA AB (SE) 2009-01-07 CN disclosed
EP-0782570-A1 SUBSTITUTED HETEROAROMATIC COMPOUNDS AND THEIR USE IN MEDICINE THE WELLCOME FOUNDATION LIMITED (GB) 1997-07-09 EP disclosed
WO-1996009294-A1 SUBSTITUTED HETEROAROMATIC COMPOUNDS AND THEIR USE IN MEDICINE THE WELLCOME FOUNDATION LIMITED (GB) 1996-03-28 WO disclosed
US-4808715-A HYPERTENSIVE AGENTS JOHN WYETH & BROTHER LIMITED (GB) 1989-02-28 US disclosed
US-4734510-A HYPOTENSIVE AGENTS JOHN WYETH & BROTHER LIMITED (GB) 1988-03-29 US disclosed
US-4640920-A HYPOTENSIVE AGENTS JOHN WYETH & BROTHER LIMITED (GB) 1987-02-03 US disclosed
US-4464375-A ANALGESIC, ANTIINFLAMMATORY SANKYO CO., LTD. (JP) 1984-08-07 US disclosed
US-4322420-A Method of using 4-anilinoquinazoline derivatives as analgesic and anti-inflammatory agents SANKYO COMPANY LIMITED (JP) 1982-03-30 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 (3 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-20100298290-A1 Benzoxazepines as Inhibitors of PI3K/mTOR and Methods of Their Use and Manufacture MTOR, RICTOR, PIK3CA PARP1 2347/4885PDE4A 1259/4885PDE4B 1027/4885
US-12390463-B2 Dosage forms and regimens for amino acid compounds ITGB6, ITGA6, ITGAV PARP1 3007/4885PDE4A 3891/4885PDE4B 3849/4885
US-20250223288-A1 AMINO ACID COMPOUNDS AND METHODS OF USE ITGB6, ITGA6, ITGA5 PARP1 3318/4885PDE4A 3921/4885PDE4B 3861/4885

“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.