SCHEMBL219410

SCHEMBL219410

O=[N+]([O-])c1cc(Br)cc(Br)c1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.55
ALDH1A1 P00352 5/20 0.50
TSHR P16473 2/20 0.50
CYP3A4 P08684 2/20 0.50
ACP1 P24666 1/20 0.46
LMNA P02545 3/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
VCAM1 P19320 1/20 0.44
HTT P42858 1/20 0.44
ESPL1 Q14674 1/20 0.44
GLA P06280 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL1026447 0.94 CYP19A1 (0.62) CYP19A1ALDH1A1TSHRCYP3A4ACP1
Nitrogen SCHEMBL27917117 0.90 CYP19A1 (0.56) CYP19A1ALDH1A1TSHRCYP3A4ACP1
Benzene SCHEMBL27782128 0.90 CYP19A1 (0.56) CYP19A1ALDH1A1TSHRCYP3A4ACP1
SCHEMBL19026582 0.87 CYP19A1 (0.68) CYP19A1ALDH1A1TSHRCYP3A4ACP1
SCHEMBL1863964 0.84 ALDH1A1 (0.52) CYP19A1ALDH1A1TSHRCYP3A4LMNA
SCHEMBL220173 0.84 LMNA (0.47) CYP19A1ALDH1A1TSHRCYP3A4ACP1
SCHEMBL2649497 0.84 CYP19A1 (0.44) CYP19A1ALDH1A1TSHRCYP3A4ACP1
SCHEMBL4432251 0.84 CYP19A1 (0.44) CYP19A1ALDH1A1TSHRCYP3A4ACP1
SCHEMBL219621 0.84 ALDH1A1 (0.50) CYP19A1ALDH1A1TSHRCYP3A4ACP1
SCHEMBL2013681 0.84 ALDH1A1 (0.50) CYP19A1ALDH1A1TSHRCYP3A4ACP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119504446-A One-pot method for preparing diphenyl aniline 西安近代化学研究所 2025-02-25 CN claimed
CN-113092384-B Preparation and detection method of micro-fluidic paper chip for rapidly detecting potassium in blood 中国人民解放军南部战区空军医院 2022-06-17 CN claimed
CN-105542165-A N-type electrochromic polymer material and preparation method thereof UNIV SOUTH CHINA TECH 2016-05-04 CN claimed
CN-122036690-A Heteroaromatic ring compound, pharmaceutical composition and application thereof 马应龙药业集团股份有限公司 2026-05-15 CN disclosed
EP-4602028-A1 CBL-B MODULATORS AND USES THEREOF Nimbus Clio, Inc. (US) 2025-08-20 EP disclosed
CN-119504446-A One-pot method for preparing diphenyl aniline 西安近代化学研究所 2025-02-25 CN disclosed
CN-119504446-A One-pot method for preparing diphenyl aniline 西安近代化学研究所 2025-02-25 CN disclosed
US-20240228482-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING CANCER HOTSPOT THERAPEUTICS, INC. 2024-07-11 US disclosed
WO-2024081311-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2024-04-18 WO disclosed
CN-117751115-A Compounds, compositions, and methods of treating cancer 热点治疗公司 2024-03-22 CN disclosed
CN-117147540-A Blood potassium detection device 自贡市第四人民医院(自贡市急救中心) 2023-12-01 CN disclosed
US-6316450-B1 PIPERAZINE COMPOUNDS FOR TREATING DEPRESSION AND ANXIETY SMITHKLINE BEECHAM P.L.C. (GB) 2001-11-13 US disclosed
EP-0994862-A2 SULPHONAMIDE DERIVATIVES BEING 5-HT6 RECEPTOR ANTAGONISTS AND PROCESS FOR THEIR PREPARATION SMITHKLINE BEECHAM PLC (GB) 2000-04-26 EP disclosed
WO-1999002502-A2 SULPHONAMIDE DERIVATIVES BEING 5-HT6 RECEPTOR ANTAGONISTS AND PROCESS FOR THEIR PREPARATION SMITHKLINE BEECHAM PLC (GB) 1999-01-21 WO disclosed
US-5652239-A TREATMENT OF STROKES, ISCHEMIC ATTACK, ANTAGONISTS OF EXCITATORY AMINO ACIDS GLUTAMATE AND ASPARTATE IMPERIAL CHEMICAL COMPANY (GB) 1997-07-29 US disclosed
EP-0512817-B1 Pyridazinedione derivatives, their preparation and pharmaceutical applications ZENECA LTD (GB) 1997-02-19 EP disclosed
EP-0512817-A1 Pyridazinedione derivatives, their preparation and pharmaceutical applications ZENECA LIMITED (GB) 1992-11-11 EP disclosed
US-4172098-A REACTION OF A HALOAMINOBENZOIC ACID WITH AN ALCOHOL AND NITROSYLATING AGENT IN THE PRESCENCE OF AN ACID AND WATER BASF AKTIENGESELLSCHAFT (DE) 1979-10-23 US disclosed
US-4053527-A REACTING HALONITROANILINES WITH ALCOHOLS AND NITROSATING AGENTS ION BASF AKTIENGESELLSCHAFT (DT) 1977-10-11 US disclosed
US-4020107-A ACIDIC PHOSPHORUS COMPOUND DEHALOGENATION INHIBITOR E. I. DU PONT DE NEMOURS AND CO. (US) 1977-04-26 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 (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-20240228482-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING CANCER TP53, CASP3, BAX CYP19A1 275/4885ALDH1A1 338/4885TSHR 4813/4885

“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.