SCHEMBL123793

SCHEMBL123793

O=[N+]([O-])c1cc(Cl)c(Cl)cc1F

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.52
ATM Q13315 1/20 0.52
ALDH1A1 P00352 5/20 0.50
HIF1A Q16665 2/20 0.50
VCAM1 P19320 3/20 0.47
TSHR P16473 4/20 0.47
MAPK1 P28482 1/20 0.47
ESPL1 Q14674 1/20 0.46
CYP3A4 P08684 2/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
TXNRD1 Q16881 1/20 0.44
TXNRD3 Q86VQ6 1/20 0.44
TXNRD2 Q9NNW7 1/20 0.44
HSD17B10 Q99714 1/20 0.43
GPR35 Q9HC97 2/20 0.42
PDE7A Q13946 2/20 0.41

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
SCHEMBL14578462 1.00 TDP1 (0.52) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL29580289 1.00 TDP1 (0.52) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL432601 0.89 TDP1 (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL30434858 0.89 TDP1 (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL138641 0.89 TDP1 (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL29739925 0.89 TDP1 (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL30953155 0.89 TDP1 (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL8967138 0.89 TDP1 (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL9694173 0.84 TSHR (0.50) TDP1ATMALDH1A1HIF1AVCAM1
SCHEMBL811001 0.84 ALDH1A1 (0.53) TDP1ATMALDH1A1HIF1AVCAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117509803-A Treatment device and treatment method for 2, 4-dichloro-5-fluoronitrobenzene waste acid mother liquor 浙江工业大学 2024-02-06 CN claimed
CN-116514723-A Synthesis method of 5, 6-2-chloro-1-ethyl-1H-benzimidazole-2-one (DCEBIO) 上海麦克林生化科技股份有限公司 2023-08-01 CN claimed
CN-102911080-B Method for preparing 2,6-dichloro-alpha-(4-chlorphenyl)-4-nitro phenylacetonitrile UNIV QUZHOU 2015-01-21 CN claimed
CN-103420842-B Preparation method for 2,3,4-trifluoronitrobenzene SHANGYU LINJIANG CHEMICAL CO LTD 2015-01-07 CN claimed
CN-102796003-B Preparation method of 2-fluoro-4,5-dichloronitrobenzene UNIV CHANGZHOU 2014-05-28 CN claimed
EP-4702021-A1 COMPOUNDS CAPABLE OF MODULATING GPR65 Pathios Therapeutics Limited (GB) 2026-03-04 EP disclosed
US-12310975-B2 Modulators of BCL6 proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2025-05-27 US disclosed
US-20240376059-A1 Compounds for the Treatment of Alzheimer's Disease THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) 2024-11-14 US disclosed
WO-2024224064-A1 COMPOUNDS CAPABLE OF MODULATING GPR65 Pathios Therapeutics Limited (GB) 2024-10-31 WO disclosed
US-20240327383-A1 PIPERIDINE DERIVATIVE, AND PHARMACEUTIAL COMPOSITION THEREOF, PREPARATION METHOD THEREFOR, AND USE THEREOF Yichang Humanwell Pharmaceutical Co., Ltd. (CN) 2024-10-03 US disclosed
CN-115611856-B Piperidine derivative and pharmaceutical composition, preparation method and application thereof 宜昌人福药业有限责任公司 2024-07-05 CN disclosed
US-20240150287-A1 N-(BENZOYL)-PHENYLALANINE COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF HANGZHOU APELOA MEDICINE RESEARCH INSTITUTE CO., LTD. (CN) 2024-05-09 US disclosed
US-5545669-A Anti-inflammatory compounds SMITHKLINE BEECHAM CORPORATION 1996-08-13 US disclosed
WO-1995033461-A1 ANTI-INFLAMMATORY COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1995-12-14 WO disclosed
WO-1995033715-A1 ANTI-INFLAMMATORY COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1995-12-14 WO disclosed
EP-0477819-B1 Benzimidazole derivatives, their preparation and use NEUROSEARCH AS (DK) 1995-03-15 EP disclosed
US-5200422-A Benzimidazole derivatives, their preparation and use NEUROSEARCH A/S (DK) 1993-04-06 US disclosed
EP-0270964-B1 PROCESS FOR OBTAINING SUBSTITUTED FLUOROBENZENES BAYER AG (DE) 1992-07-08 EP disclosed
EP-0477819-A2 Benzimidazole derivatives, their preparation and use NEUROSEARCH A/S (DK) 1992-04-01 EP disclosed
US-4868347-A SOLVENT EXTRACTION BAYER AKTIENGESELLSCHAFT (DE) 1989-09-19 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 (4 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-20240327383-A1 PIPERIDINE DERIVATIVE, AND PHARMACEUTIAL COMPOSITION THEREOF, PREPARATION METHOD THEREFOR, AND USE THEREOF OPRL1, OPRD1, OPRM1 TDP1 2672/4885ATM 4844/4885ALDH1A1 188/4885
US-20240150287-A1 N-(BENZOYL)-PHENYLALANINE COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF ITGB7, ITGB4, ITGA4 TDP1 3499/4885ATM 4513/4885ALDH1A1 988/4885
US-12310975-B2 Modulators of BCL6 proteolysis and associated methods of use BCL6, BCL6B, BCL3 TDP1 1700/4885ATM 2479/4885ALDH1A1 3306/4885
US-20240376059-A1 Compounds for the Treatment of Alzheimer's Disease IAPP, GPR119, APP TDP1 1690/4885ATM 1025/4885ALDH1A1 4515/4885

“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.