SCHEMBL173192

SCHEMBL173192

O=[N+]([O-])c1ccc(CI)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.61
TSHR P16473 1/20 0.57
IDO1 P14902 3/20 0.55
CYP2C19 P33261 3/20 0.53
ALDH1A1 P00352 3/20 0.53
POLB P06746 1/20 0.53
CYP1A2 P05177 2/20 0.50
ACHE P22303 1/20 0.50
HSD17B10 Q99714 1/20 0.50
CYP2C9 P11712 1/20 0.50
KCNJ1 P48048 1/20 0.50
KCNH2 Q12809 1/20 0.50
AKR1C3 P42330 1/20 0.48
CHRM2 P08172 1/20 0.48
PTPRF P10586 1/20 0.48
PTPN2 P17706 1/20 0.48
PTPN1 P18031 1/20 0.48
PTPN11 Q06124 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL27689131 0.89 ALDH1A1 (0.60) LOXL2TSHRCYP2C19ALDH1A1POLB
Acetic Acid SCHEMBL6037809 0.88 MAPK1 (0.53) LOXL2TSHRIDO1CYP2C19ALDH1A1
SCHEMBL2588477 0.84 TSHR (0.67) LOXL2TSHRIDO1CYP2C19ALDH1A1
SCHEMBL300767 0.83 LOXL2 (0.64) LOXL2TSHRIDO1CYP2C19ALDH1A1
SCHEMBL8094050 0.80 POLB (0.76) LOXL2TSHRIDO1CYP2C19ALDH1A1
SCHEMBL8087428 0.80 POLB (0.76) LOXL2TSHRIDO1CYP2C19ALDH1A1
SCHEMBL44366 0.80 POLB (0.76) LOXL2TSHRIDO1CYP2C19ALDH1A1
SCHEMBL3292782 0.80 TSHR (0.75) LOXL2TSHRIDO1CYP2C19ALDH1A1
SCHEMBL250472 0.79 TSHR (0.67) LOXL2TSHRIDO1CYP2C19ALDH1A1
SCHEMBL22567 0.79 ALDH1A1 (0.72) LOXL2TSHRALDH1A1ACHEHSD17B10

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-117105790-A Method for preparing p-nitrobenzaldehyde from p-nitrobenzyl halide 青岛科技大学 2023-11-24 CN claimed
EP-1618122-A1 SYNTHESIS OF SOLANUM GLYCOSIDES GlycoMed Sciences (UK) Limited, c/o Consolidated Capital Limited (GB) 2006-01-25 EP claimed
WO-2004096830-A1 SYNTHESIS OF SOLANUM GLYCOSIDES GLYCOMED SCIENCES (UK) LIMITED (GB) 2004-11-11 WO claimed
US-20010039349-A1 Selective, Catalytic, thermal functionalization of secondary or aromatic C-H cyclic hydrocarbon bonds SHELL OIL COMPANY 2001-11-08 US claimed
CN-1112548-A Polyiodinated compounds, process for preparing them and diagnostic compositions GUERBET SA (FR) 1995-11-29 CN claimed
US-4257915-A USE IN PHOTOPOLYMERIZATION OF ETHYLENICALLY UNSATURATED MONOMERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-03-24 US claimed
US-12534563-B2 Block copolymer, resin composition, stretch conductor, electronic device, and pressure-sensitive adhesive film ARTIENCE CO., LTD. (JP) 2026-01-27 US disclosed
EP-4406979-B1 COMPOUND AND PRODUCTION METHOD FOR COMPOUND DENKA COMPANY LTD (JP) 2025-11-12 EP disclosed
US-20240400740-A1 COMPOUND AND METHOD OF PRODUCING THE COMPOUND DENKA COMPANY LIMITED (JP) 2024-12-05 US disclosed
EP-4406979-A1 COMPOUND AND PRODUCTION METHOD FOR COMPOUND Denka Company Limited (JP) 2024-07-31 EP disclosed
CN-114716296-B Efficient halogenation synthesis method of alkyl halide 润药仁智(北京)科技有限公司 2023-12-12 CN disclosed
WO-2023062931-A1 COMPOUND AND PRODUCTION METHOD FOR COMPOUND デンカ株式会社 2023-04-20 WO disclosed
US-20230050336-A1 BLOCK COPOLYMER, RESIN COMPOSITION, STRETCH CONDUCTOR, ELECTRONIC DEVICE, AND PRESSURE-SENSITIVE ADHESIVE FILM TOYO INK SC HOLDINGS CO., LTD. (JP) 2023-02-16 US disclosed
US-4146558-A Azo dyestuff intermediate nitro- or aminobenzenes ring-substituted by a quaternized amine alkyl or amino-alkoxy group STERLING DRUG INC. (US) 1979-03-27 US disclosed
US-4103092-A Water-soluble quaternary ammonium non-heterocyclic azo dyestuffs STERLING DRUG INC. (US) 1978-07-25 US disclosed
US-4065500-A Water-soluble quaternary ammonium azo dyestuffs STERLING DRUG INC. (US) 1977-12-27 US disclosed
US-4051168-A TO FORM FLUOROALKYL AROMATIC COMPOUNDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-09-27 US disclosed
US-3996282-A Water-soluble quaternary ammonium dyestuffs STERLING DRUG INC. (US) 1976-12-07 US disclosed
US-3949085-A Anabolic-weight-gain promoting compositions containing isoflavone derivatives and method using same CHINOIN GYOGYSZER-ES VEGYESZETI TERMAKEK GYARA RT (HU) 1976-04-06 US disclosed
US-3935182-A Water-soluble quaternary ammonium heterocyclic azo dyestuffs STERLING DRUG INC. (US) 1976-01-27 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-12534563-B2 Block copolymer, resin composition, stretch conductor, electronic device, and pressure-sensitive adhesive film EPB41, ITGB4, ITGB5 LOXL2 1801/4885TSHR 657/4885IDO1 3773/4885
US-20010039349-A1 Selective, Catalytic, thermal functionalization of secondary or aromatic C-H cyclic hydrocarbon bonds AHR, PAH, HRH3 LOXL2 2971/4885TSHR 1650/4885IDO1 1217/4885

“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.