SCHEMBL29686335

SCHEMBL29686335

O=[N+]([O-])c1c(F)ccc(Br)c1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VCP P55072 1/20 0.40
ALDH1A1 P00352 5/20 0.38
HIF1A Q16665 1/20 0.38
VCAM1 P19320 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
ATM Q13315 1/20 0.35
TSHR P16473 2/20 0.34
RIPK1 Q13546 1/20 0.34
MAPT P10636 2/20 0.33
PTGER4 P35408 1/20 0.33
PKM P14618 1/20 0.33
MAPK1 P28482 2/20 0.33
CASP6 P55212 1/20 0.33
TYMS P04818 1/20 0.32
PDE7A Q13946 2/20 0.32
PDE7B Q9NP56 2/20 0.32
CYP2D6 P10635 1/20 0.32
CYP3A4 P08684 1/20 0.31
PMM2 O15305 1/20 0.31
MPI P34949 1/20 0.31

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
SCHEMBL16739101 1.00 VCP (0.40) VCPALDH1A1HIF1AVCAM1TDP1
SCHEMBL25411924 0.87 ALDH1A1 (0.37) VCPALDH1A1HIF1ATDP1ATM
SCHEMBL26908251 0.83 VCP (0.40) VCPALDH1A1HIF1AVCAM1TDP1
SCHEMBL1340438 0.82 ALDH1A1 (0.43) ALDH1A1HIF1AVCAM1TDP1ATM
SCHEMBL29860351 0.82 ALDH1A1 (0.43) ALDH1A1HIF1AVCAM1TDP1ATM
SCHEMBL239430 0.80 MEN1 (0.41) ALDH1A1TDP1TSHRMAPTTYMS
SCHEMBL6227151 0.80 VCP (0.38) VCPALDH1A1HIF1AVCAM1TDP1
SCHEMBL2463690 0.80 GRIN2D (0.41) VCPALDH1A1HIF1AVCAM1TDP1
SCHEMBL20797684 0.80 PTGER4 (0.48) VCPALDH1A1HIF1AVCAM1TDP1
SCHEMBL20471631 0.80 ALDH1A1 (0.33) VCPALDH1A1TDP1MAPTPTGER4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122094958-A PARP1 inhibitors and uses thereof 2026-05-26 CN disclosed
CN-122059929-A Quinoxaline derivatives as anticancer agents 阿斯利康(瑞典)有限公司 2026-05-19 CN disclosed
CN-122036687-A Quinoxaline derivatives as anticancer agents 阿斯利康(瑞典)有限公司 2026-05-15 CN disclosed
CN-122036686-A Quinoxaline derivatives as anticancer agents 阿斯利康(瑞典)有限公司 2026-05-15 CN disclosed
CN-122010903-A Quinoxaline derivatives as anticancer agents 阿斯利康(瑞典)有限公司 2026-05-12 CN disclosed
EP-4655073-A2 CEREBLON-BASED KRAS DEGRADING PROTACS ANS USES RELATED THERETO Arvinas Operations, Inc. (US) 2025-12-03 EP disclosed
EP-4613752-A1 POLYCYCLIC POLY(ADP-RIBOSE) POLYMERASE SELECTIVE INHIBITOR Xuanzhu Biopharmaceutical Co., Ltd. (CN) 2025-09-10 EP disclosed
US-20250270224-A1 POLYCYCLIC POLY(ADP-RIBOSE) POLYMERASE SELECTIVE INHIBITOR Xuanzhu Biopharmaceutical Co., Ltd. (CN) 2025-08-28 US disclosed
CN-120092010-A Polycyclic poly (ADP-ribose) polymerase selective inhibitors 轩竹生物科技股份有限公司 2025-06-03 CN disclosed
WO-2025096856-A1 COVALENT CEREBLON LIGANDS C4 THERAPEUTICS, INC. (US) 2025-05-08 WO disclosed
CN-116964037-A Diaminotriazine compounds 巴斯夫欧洲公司 2023-10-27 CN disclosed
CN-116891456-A Heterocyclic derivative inhibitor, preparation method and application thereof 上海翰森生物医药科技有限公司 2023-10-17 CN disclosed
CN-116867758-A IRAK degradation agents and uses thereof 凯麦拉医疗公司 2023-10-10 CN disclosed
WO-2023118085-A1 METHODS OF TREATING BRAIN TUMOURS AND NEUROBLASTOMAS ASTRAZENECA AB (SE) 2023-06-29 WO disclosed
EP-4172152-A1 QUINOXALINE DERIVATIVES AS ANTI-CANCER DRUGS Astrazeneca AB (SE) 2023-05-03 EP disclosed
CN-115768760-A Quinoxaline derivatives as anti-cancer agents 阿斯利康(瑞典)有限公司 2023-03-07 CN disclosed
CN-114981267-A MKK4 inhibitor 3-benzoyl-1H-pyrrolo [2,3-B ] pyridine derivatives for the treatment of liver diseases 海帕瑞吉尼克斯股份有限公司 2022-08-30 CN disclosed
CN-109734674-B Aniline WDR5 protein-protein interaction inhibitor and preparation method and application thereof 中国药科大学 2022-08-26 CN disclosed
WO-2022161801-A1 DIAMINOTRIAZINE COMPOUNDS BASF SE (DE) 2022-08-04 WO disclosed
EP-3288931-B2 CERTAIN PROTEIN KINASE INHIBITOR CHONGQING FOCHON PHARMACEUTICAL CO LTD (CN) 2022-07-20 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 (1 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-20250270224-A1 POLYCYCLIC POLY(ADP-RIBOSE) POLYMERASE SELECTIVE INHIBITOR PARP1, PARP11, PARP2 VCP 2979/4885ALDH1A1 1101/4885HIF1A 3172/4885

“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.