SCHEMBL119145

SCHEMBL119145

Cc1ccc(CBr)cc1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.44
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
ACHE P22303 1/20 0.37
KMT2A Q03164 2/20 0.35
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
ALDH1A1 P00352 3/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
NPSR1 Q6W5P4 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33

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
SCHEMBL29783285 1.00 DAO (0.44) DAOHDAC1HDAC6ACHEKMT2A
SCHEMBL31399100 0.87 DAO (0.41) DAOHDAC1HDAC6ACHEKMT2A
SCHEMBL31058524 0.83 DAO (0.41) DAOHDAC1HDAC6ACHEKMT2A
SCHEMBL177531 0.82 SLC6A2 (0.44) DAOHDAC1ACHECYP4F2CYP4A11
SCHEMBL18551846 0.81 DAO (0.59) DAOHDAC1HDAC6ACHEKMT2A
SCHEMBL19599385 0.81 DAO (0.50) DAOHDAC1HDAC6ACHEKMT2A
SCHEMBL8251560 0.79 HRH3 (0.50) DAOHDAC6KMT2AALDH1A1MEN1
SCHEMBL13862873 0.79 DAO (0.45) DAOHDAC1HDAC6ACHEKMT2A
SCHEMBL7712089 0.79 DAO (0.45) DAOHDAC1HDAC6ACHEKMT2A
SCHEMBL8251603 0.78 HRH3 (0.46) DAOALDH1A1SLC6A2SLC6A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116640106-B Phenylpiperazine compound and preparation method and application thereof 郑州大学 2024-03-08 CN claimed
CN-116640106-A Phenylpiperazine compound and preparation method and application thereof 郑州大学 2023-08-25 CN claimed
US-20250163029-A1 PYRIDONE OR PYRIMIDONE DERIVATIVE AND APPLICATION THEREOF MEDSHINE DISCOVERY INC. (CN) 2025-05-22 US disclosed
US-20250011289-A1 1H-BENZO[B]AZEPIN-2(3H)-ONE COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING CANCER J. MICHAEL BISHOP INSTITUTE OF CANCER RESEARCH (CN) 2025-01-09 US disclosed
EP-3227270-B1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C RES LAB (KR) 2024-11-13 EP disclosed
US-20240270695-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS J. MICHAEL BISHOP INSTITUTE OF CANCER RESEARCH (CN) 2024-08-15 US disclosed
CN-116640106-B Phenylpiperazine compound and preparation method and application thereof 郑州大学 2024-03-08 CN disclosed
CN-116710442-A Compounds, compositions and methods for treating disorders 成都安泰康赛生物科技有限公司 2023-09-05 CN disclosed
CN-116640106-A Phenylpiperazine compound and preparation method and application thereof 郑州大学 2023-08-25 CN disclosed
WO-2023155830-A1 PYRIDONE OR PYRIMIDONE DERIVATIVE AND APPLICATION THEREOF 南京明德新药研发有限公司 2023-08-24 WO disclosed
US-11718612-B2 Inhibitors of receptor interacting protein kinase I for the treatment of disease BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-08-08 US disclosed
WO-2005082909-A1 GLUCOCORTICOID RECEPTOR MODULATOR COMPOUNDS AND METHODS- UTILITY LIGAND PHARMACEUTICALS INCORPORATED (US) 2005-09-09 WO disclosed
WO-2005054179-A2 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF LEO PHARMA A/S (DK) 2005-06-16 WO disclosed
WO-2005051399-A1 7-PHENYLSULFONYL-TETRAHYDRO-3-BENZAZEPINE DERIVATIVES AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LIMITED (GB) 2005-06-09 WO disclosed
US-20050119295-A1 Fused heterocyclic compounds JANSSEN PHARMACEUTICA, N.V. (BE) 2005-06-02 US disclosed
WO-2005040169-A2 FUSED HETEROCYCLIC COMPOUNDS AS SEROTONIN RECEPTOR MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2005-05-06 WO disclosed
WO-2004085403-A1 TETRAHYDROISOQUINOLYL ACETAMIDE DERIVATIVES FOR USE AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2004-10-07 WO disclosed
CN-1101813-C 3-pyrazolecarboxamide derivs. having cannabinoid receptor affinity SANOFI SYNTHELABO (FR) 2003-02-19 CN disclosed
US-5925768-A ANTIINFLAMMATORY AGENTS; ANALGESICS, ANTICOAGULANTS, NARCOTICS SANOFI (FR) 1999-07-20 US disclosed
CN-1207731-A 3-pyrazolecarboxamide derivs. having cannabinoid receptor affinity SANOFI SA (FR) 1999-02-10 CN 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 (5 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-20240270695-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING DISORDERS CYP27A1, PNLIP, GOT2 DAO 3222/4885HDAC1 973/4885HDAC6 148/4885
US-11718612-B2 Inhibitors of receptor interacting protein kinase I for the treatment of disease RIPK1, RIPK2, RIPK4 DAO 4271/4885HDAC1 1401/4885HDAC6 1652/4885
US-20050119295-A1 Fused heterocyclic compounds TPH1, HTR3A, HTR3B DAO 1178/4885HDAC1 560/4885HDAC6 466/4885
US-20250011289-A1 1H-BENZO[B]AZEPIN-2(3H)-ONE COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING CANCER BRCA1, TP53, BCCIP DAO 4396/4885HDAC1 185/4885HDAC6 189/4885
US-20250163029-A1 PYRIDONE OR PYRIMIDONE DERIVATIVE AND APPLICATION THEREOF DPYD, PNPO, TYMP DAO 701/4885HDAC1 3636/4885HDAC6 2723/4885

“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.