SCHEMBL853676

SCHEMBL853676

O=C(CCl)Nc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.65
KMT2A Q03164 4/20 0.65
HTT P42858 4/20 0.63
MAPT P10636 4/20 0.63
ALDH1A1 P00352 4/20 0.63
LMNA P02545 3/20 0.59
PRMT1 Q99873 1/20 0.59
HSP90AA1 P07900 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
HPGD P15428 1/20 0.56
NPC1 O15118 2/20 0.56
MITF O75030 2/20 0.56
RAB9A P51151 2/20 0.56
XBP1 P17861 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
NOD2 Q9HC29 1/20 0.56
TGM2 P21980 1/20 0.56
POLB P06746 2/20 0.55
NAMPT P43490 1/20 0.54

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
4-Nitroaniline SCHEMBL3978656 0.92 ALDH1A1 (0.56) MEN1KMT2AHTTMAPTALDH1A1
SCHEMBL23748585 0.91 MEN1 (0.70) MEN1KMT2AHTTMAPTALDH1A1
SCHEMBL10923174 0.91 NPSR1 (0.73) MEN1KMT2AHTTMAPTALDH1A1
SCHEMBL6407959 0.88 MEN1 (0.59) MEN1KMT2AHTTMAPTALDH1A1
SCHEMBL9018657 0.87 MEN1 (0.71) MEN1KMT2AHTTMAPTALDH1A1
SCHEMBL1429699 0.86 MEN1 (0.65) MEN1KMT2AHTTMAPTALDH1A1
SCHEMBL5118037 0.84 HTT (0.51) MEN1KMT2AHTTMAPTALDH1A1
SCHEMBL7741358 0.84 MEN1 (0.67) MEN1KMT2AHTTMAPTALDH1A1
SCHEMBL4746770 0.83 MEN1 (0.63) MEN1KMT2AHTTMAPTALDH1A1
SCHEMBL9081388 0.82 NPC1 (0.76) MEN1KMT2AHTTMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111004141-B New method for synthesizing nintedanib intermediate 2-chloro-N-methyl-N- (4-nitrophenyl) acetamide 苏州诚和医药化学有限公司 2022-10-04 CN claimed
CN-111004141-A Novel method for synthesizing Nintedanib intermediate 2-chloro-N-methyl-N- (4-nitrophenyl) acetamide 苏州诚和医药化学有限公司 2020-04-14 CN claimed
CN-101638391-A 2-[(substituted aminobenzene)carbonylmethylthio]-6-(2,6-dichlorobenzyl)-3H-pyrimidyl-4-ketone derivative and preparation method and application thereof UNIV SHANDONG 2010-02-03 CN claimed
WO-2025215121-A1 HEDGEHOG ACYLTRANSFERASE INHIBITORS IMPERIAL COLLEGE INNOVATIONS LIMITED (GB) 2025-10-16 WO disclosed
EP-4622986-A1 BORONIC ACID AND BORONATE COMPOSITIONS AND METHODS Elima Therapeutics, Inc. (US) 2025-10-01 EP disclosed
US-12214338-B1 Acid treatment method for making organoselenium composite IMAM MOHAMMAD IBN SAUD ISLAMIC UNIVERSITY (SA) 2025-02-04 US disclosed
US-12179185-B1 Method of treating palm waste to form organoselenium nanocomposite IMAM MOHAMMAD IBN SAUD ISLAMIC UNIVERSITY (SA) 2024-12-31 US disclosed
US-12115524-B1 Method of producing organoselenium-based nanocomposite IMAM MOHAMMAD IBN SAUD ISLAMIC UNIVERSITY (SA) 2024-10-15 US disclosed
CN-118496218-A Carbazole-oxadiazole alpha-glucosidase and alpha-amylase double-target inhibitor and preparation method and application thereof 贵州医科大学 2024-08-16 CN disclosed
CN-118126030-A Preparation method of pyrazoline-1, 3, 4-oxadiazole thioacetamide derivative and application of pyrazoline-1, 3, 4-oxadiazole thioacetamide derivative as pesticide 贵州大学 2024-06-04 CN disclosed
WO-2024112705-A1 BORONIC ACID AND BORONATE COMPOSITIONS AND METHODS ELIMA THERAPEUTICS, INC. (US) 2024-05-30 WO disclosed
US-4251657-A Method for removing protective groups TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1981-02-17 US disclosed
US-4206144-A N,N-Dialkyl-N-aminoalkyl-N-(amino or nitro)phenylalkyl- and N-methyl-N-[3-(amino or nitro)phenoxy-2-hydroxy-1-propyl]-N,N-bis(3-aminopropyl)quaternary ammonium salts STERLING DRUG INC. (US) 1980-06-03 US disclosed
EP-0006722-A1 Derivatives of (4-(piperazin-1-yl-phenyloxymethyl)-1.3-dioxolan-2-ylmethyl)-1H-imidazoles and -1H-1.2.4-triazoles, their preparation and use as fungicides and bactericides JANSSEN PHARMACEUTICA N.V. (BE) 1980-01-09 EP 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-4102924-A REACTING ACYLAMINO-ARYLS WITH HALO-ARYLS BAYER AKTIENGESELLSCHAFT (DE) 1978-07-25 US disclosed
US-4065500-A Water-soluble quaternary ammonium azo dyestuffs STERLING DRUG INC. (US) 1977-12-27 US disclosed
US-3996282-A Water-soluble quaternary ammonium dyestuffs STERLING DRUG INC. (US) 1976-12-07 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 (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-12179185-B1 Method of treating palm waste to form organoselenium nanocomposite LCAT, PHOSPHO1, SOAT1 MEN1 2614/4885KMT2A 891/4885HTT 2104/4885
US-12214338-B1 Acid treatment method for making organoselenium composite LCAT, PHOSPHO1, AS3MT MEN1 2171/4885KMT2A 1082/4885HTT 1749/4885
US-12115524-B1 Method of producing organoselenium-based nanocomposite LCAT, PHOSPHO1, SOAT1 MEN1 2149/4885KMT2A 1084/4885HTT 2230/4885

“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.