SCHEMBL970971

SCHEMBL970971

O=[N+]([O-])c1cccc(O)c1Br

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 4/20 0.62
TDP1 Q9NUW8 2/20 0.50
ERN1 O75460 1/20 0.47
CTSB P07858 1/20 0.46
ALDH1A1 P00352 4/20 0.44
CXCR2 P25025 1/20 0.44
TSHR P16473 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
CSNK2A2 P19784 2/20 0.44
CSNK2B P67870 2/20 0.44
CSNK2A1 P68400 2/20 0.44
CSNK2A3 Q8NEV1 2/20 0.44
KCNMA1 Q12791 1/20 0.44
MAPK1 P28482 2/20 0.42
TP53 P04637 1/20 0.42
HPGD P15428 1/20 0.42
S100A4 P26447 1/20 0.42
SNCA P37840 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42

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
Methylene Chloride SCHEMBL27533036 0.93 GPR35 (0.55) GPR35TDP1ERN1CTSBALDH1A1
SCHEMBL3126302 0.89 GPR35 (0.65) GPR35TDP1ERN1ALDH1A1TSHR
Selenium SCHEMBL11463644 0.87 GPR35 (0.62) GPR35TDP1ERN1ALDH1A1TSHR
SCHEMBL12344881 0.81 GPR35 (0.44) GPR35TDP1ERN1ALDH1A1TSHR
SCHEMBL4582709 0.81 SMN1; SMN2 (0.52) GPR35TDP1CTSBALDH1A1TSHR
SCHEMBL29254179 0.79 GPR35 (0.54) GPR35TDP1ERN1ALDH1A1TSHR
SCHEMBL29431835 0.78 TDP1 (0.54) GPR35TDP1ERN1CTSBALDH1A1
SCHEMBL29431836 0.78 TDP1 (0.54) GPR35TDP1ERN1CTSBALDH1A1
SCHEMBL6280266 0.78 GPR35 (0.67) GPR35TDP1ERN1CTSBALDH1A1
SCHEMBL70167 0.78 GPR35 (0.78) GPR35TDP1ERN1CTSBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107266356-A It is a kind of to be used as carbazole compound of autotaxin inhibitors and its preparation method and application 山西省生物研究所 2017-10-20 CN claimed
US-7219735-B2 Immiscible with capping fluid; preventing pollution; kits INNOVATIVE CHEMICAL TECHNOLOGIES CANADA LTD. (CA) 2007-05-22 US claimed
US-20040087448-A1 Packer fluid Lubrizol Oilfield Solutions, Inc. 2004-05-06 US claimed
EP-4733299-A1 SULFUR-CONTAINING FUSED RING COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND PREPARATION METHOD THEREFOR AND USE THEREOF Shenzhen Braegen Pharmaceutical Co., Ltd. (CN) 2026-04-29 EP disclosed
CN-121202909-A Synthesis method of 3-amino-2- (tert-butyldimethylsilyl) phenyl trifluoro methane sulfonate 上海毕臣生化科技有限公司 2025-12-26 CN disclosed
CN-120041206-A Fluorescent composite nanomaterial for detecting triclosan and preparation method and application thereof 德州学院 2025-05-27 CN disclosed
WO-2025106644-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF ALPHA-V BETA-1 INTEGRIN MORPHIC THERAPEUTIC, INC. (US) 2025-05-22 WO disclosed
CN-116554050-B Amide phenol derivative and application thereof 四川大学 2025-03-18 CN disclosed
WO-2024240186-A1 SULFUR-CONTAINING FUSED RING COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND PREPARATION METHOD THEREFOR AND USE THEREOF 深圳博芮健制药有限公司 2024-11-28 WO disclosed
CN-116925100-A Substituted thiophenoquinolinone compound and preparation method and application thereof 深圳信立泰药业股份有限公司 2023-10-24 CN disclosed
CN-116554050-A Amide phenol derivative and application thereof 四川大学 2023-08-08 CN disclosed
US-20040147515-A1 3-Aminophenol derivatives substituted in the 2-position, and dyes containing these compounds WELLA AKTIENGESELLSCHAFT (DE) 2004-07-29 US disclosed
CN-1505613-A Substituted indoles, pharmaceutical compositions containing such indoles and their use as ppar-gamma binding agents ʷ��˿�������ȳ�ķ���޹�˾ 2004-06-16 CN disclosed
US-20040087448-A1 Packer fluid Lubrizol Oilfield Solutions, Inc. 2004-05-06 US disclosed
WO-2003087034-A1 3-AMINOPHENOL DERIVATIVES SUBSTITUTED IN THE 2-POSITION, AND DYES CONTAINING THESE COMPOUNDS WELLA AKTIENGESELLSCHAFT (DE) 2003-10-23 WO disclosed
WO-2003087084-A1 3-AMINOPHENOL DERIVATIVES AND DYES THAT CONTAIN THESE COMPOUNDS WHILE SERVING TO DYE KERATIN FIBERS WELLA AKTIENGESELLSCHAFT (DE) 2003-10-23 WO disclosed
EP-1341761-A1 SUBSTITUTED INDOLES, PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH INDOLES AND THEIR USE AS PPAR-$g(g) BINDING AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2003-09-10 EP disclosed
US-20030087902-A1 Substituted indoles, pharmaceutical compounds containing such indoles and their use as PPAR-gamma binding agents SMITHKLINE BEECHAM CORPORATION 2003-05-08 US disclosed
WO-2002030895-A1 SUBSTITUTED INDOLES, PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH INDOLES AND THEIR USE AS PPAR-η BINDING AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2002-04-18 WO disclosed
US-6110961-A USEFUL IN PROPHYLAXIS AND TREATMENT OF MENTAL DISORDERS, SUCH AS DEPRESSION, ANXIETY KRENITSKY PHARMACEUTICALS, INC. (US) 2000-08-29 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 (2 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-20030087902-A1 Substituted indoles, pharmaceutical compounds containing such indoles and their use as PPAR-gamma binding agents PPARG, PPARA, PPARD GPR35 52/4885TDP1 3346/4885ERN1 3556/4885
US-20040147515-A1 3-Aminophenol derivatives substituted in the 2-position, and dyes containing these compounds ALPP, TYR, RB1 GPR35 2415/4885TDP1 1942/4885ERN1 4799/4885

“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.