SCHEMBL165733

SCHEMBL165733

O=[N+]([O-])c1ccc(Br)cc1Br

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.49
AAK1 Q2M2I8 1/20 0.47
S100A4 P26447 1/20 0.47
TRPV1 Q8NER1 1/20 0.47
ALDH1A1 P00352 3/20 0.44
CYP3A4 P08684 2/20 0.44
TSHR P16473 3/20 0.43
HSP90AA1 P07900 1/20 0.43
TLR9 Q9NR96 1/20 0.43
CTSB P07858 1/20 0.43
TDP1 Q9NUW8 2/20 0.42
MAPK1 P28482 2/20 0.42
ATM Q13315 1/20 0.42
IDO1 P14902 1/20 0.41
GPR35 Q9HC97 1/20 0.41
MAPT P10636 1/20 0.41
CYP2D6 P10635 1/20 0.41
PKM P14618 1/20 0.40
RAB9A P51151 1/20 0.40
PDE7A Q13946 1/20 0.40

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
SCHEMBL29431838 1.00 CYP19A1 (0.49) CYP19A1AAK1S100A4TRPV1ALDH1A1
Phenol SCHEMBL28274563 0.86 CRHBP (0.45) CYP19A1AAK1S100A4TRPV1ALDH1A1
SCHEMBL1561802 0.84 TSHR (0.56) S100A4TRPV1ALDH1A1CYP3A4TSHR
SCHEMBL9197991 0.82 AAK1 (0.60) CYP19A1AAK1ALDH1A1CYP3A4TSHR
SCHEMBL24508 0.82 S100A4 (0.56) S100A4TRPV1ALDH1A1CYP3A4HSP90AA1
SCHEMBL26205134 0.82 S100A4 (0.56) S100A4TRPV1ALDH1A1CYP3A4TSHR
SCHEMBL29395434 0.82 S100A4 (0.56) S100A4TRPV1ALDH1A1CYP3A4HSP90AA1
SCHEMBL3804579 0.80 GPR35 (0.59) CYP19A1AAK1S100A4ALDH1A1CYP3A4
SCHEMBL229154 0.78 BACE1 (0.49) CYP19A1AAK1ALDH1A1CYP3A4TSHR
SCHEMBL1631770 0.78 TDP1 (0.64) CYP19A1AAK1ALDH1A1CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118179542-A Carbon-based catalyst, and preparation method and application thereof 中国石油化工股份有限公司 2024-06-14 CN claimed
CN-111434651-B Aromatic pyridazine compound, preparation method and application 天津大学 2023-08-22 CN claimed
CN-109467535-B Preparation method of fenbendazole 江苏宝众宝达药业有限公司 2022-07-12 CN claimed
CN-111434651-A Aromatic pyridazine compound, preparation method and application 天津大学 2020-07-21 CN claimed
CN-104649954-A Phenanthrocarbazole derivative and application of phenanthrocarbazole derivative in organic electroluminescence devices BEIJING ETERNAL MATERIAL TECHNOLOGY CO LTD 2015-05-27 CN claimed
CN-104193648-A Preparation method for organic azides UNIV KUNMING SCIENCE & TECHNOLOGY 2014-12-10 CN claimed
US-5808164-A Process for producing aromatic sulfides PHILLIPE PETROLEUM COMPANY (US) 1998-09-15 US claimed
US-5618981-A Process for producing aromatic sulfides PHILLIPS PETROLEUM COMPANY (US) 1997-04-08 US claimed
EP-3321268-B1 BICYCLIC HETEROARYL DERIVATIVES AS MNK1 AND MNK2 MODULATORS AND USES THEREOF AGENCY SCIENCE TECH & RES (SG) 2025-06-04 EP disclosed
US-20250042902-A1 TRICYCLIC CRBN LIGANDS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2025-02-06 US disclosed
CN-118179542-A Carbon-based catalyst, and preparation method and application thereof 中国石油化工股份有限公司 2024-06-14 CN disclosed
US-11980089-B2 Compound and organic light emitting device comprising same LG CHEM, LTD. (KR) 2024-05-07 US disclosed
EP-3316335-B1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO LTD (KR) 2024-03-27 EP disclosed
US-11897882-B2 Tricyclic crbn ligands and uses thereof KYMERA THERAPEUTICS, INC. (US) 2024-02-13 US disclosed
EP-0341496-B1 Modified diene polymer rubbers SUMITOMO CHEMICAL CO (JP) 1993-10-20 EP disclosed
US-5219938-A Reacting a living polymer of a conjugated diene with a tin or silicon compound and with a nitro compound, a phosphoryl chloride, aminosilane, an acrylamide or an aminovinylsilane; auto tires; impact strength; cold resistance; storage SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-06-15 US disclosed
US-5128416-A Automobile tire treads SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-07-07 US disclosed
US-5015692-A Rubbers for tires having impact strength SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-05-14 US disclosed
US-4957976-A IMPROVED PROPERTIES FOR AUTOMOBILE TIRES, MODIFIED WITH PHOSPHORYL CHLORIDE SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1990-09-18 US disclosed
US-4212824-A PLATINUM, IRON OXIDE OR HYDROXIDE ON CARBON BLACK E. I. DU PONT DE NEMOURS AND COMPANY (US) 1980-07-15 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 (3 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-11897882-B2 Tricyclic crbn ligands and uses thereof CRBN, CRKL, CUL4A CYP19A1 3524/4885AAK1 2681/4885S100A4 1748/4885
US-20250042902-A1 TRICYCLIC CRBN LIGANDS AND USES THEREOF CRBN, CRKL, CUL4A CYP19A1 3524/4885AAK1 2681/4885S100A4 1748/4885
US-11980089-B2 Compound and organic light emitting device comprising same CRY1, CYP1A1, CRY2 CYP19A1 21/4885AAK1 3259/4885S100A4 2865/4885

“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.