SCHEMBL480106

SCHEMBL480106

CC(=O)c1ccc([N+](=O)[O-])cc1Cl

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.70
MAPT P10636 6/20 0.67
GAA P10253 2/20 0.58
MAPK1 P28482 2/20 0.58
HTT P42858 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
RAB9A P51151 5/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
NPC1 O15118 4/20 0.58
POLB P06746 2/20 0.58
MCL1 Q07820 1/20 0.58
HSD17B10 Q99714 1/20 0.58
TDP1 Q9NUW8 2/20 0.56
ALDH1A1 P00352 1/20 0.56
FLT1 P17948 1/20 0.54
FLT4 P35916 1/20 0.54
KDR P35968 1/20 0.54
MEN1 O00255 1/20 0.52

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
SCHEMBL1762503 0.86 KMT2A (0.61) KMT2AMAPTGAAMAPK1NPSR1
SCHEMBL231457 0.84 KMT2A (0.72) KMT2AMAPTGAAMAPK1HTT
SCHEMBL752917 0.84 KMT2A (0.72) KMT2AMAPTGAAMAPK1HTT
SCHEMBL3656114 0.83 MAPK1 (0.57) KMT2AMAPTMAPK1HTTSMN1; SMN2
Aklomide SCHEMBL328368 0.82 KMT2A (1.00) KMT2AMAPTGAAMAPK1HTT
SCHEMBL11054244 0.82 KMT2A (0.70) KMT2AMAPTGAAMAPK1HTT
SCHEMBL8447117 0.82 KMT2A (0.70) KMT2AMAPTGAAMAPK1HTT
SCHEMBL8447120 0.82 KMT2A (0.70) KMT2AMAPTGAAMAPK1HTT
Potassium Ion SCHEMBL11056843 0.82 KMT2A (0.70) KMT2AMAPTGAAMAPK1HTT
Hydrochloric Acid SCHEMBL6222540 0.82 KMT2A (0.70) KMT2AMAPTGAAMAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11773118-B2 Methods of making high enantioselective secondary alcohols OBI PHARMA, INC. (TW) 2023-10-03 US disclosed
US-11773118-B2 Methods of making high enantioselective secondary alcohols OBI PHARMA, INC. (TW) 2023-10-03 US disclosed
US-20230286904-A1 INHIBITORS OF YAP/TAZ-TEAD ONCOPROTEINS, SYNTHESIS AND USE THEREOF BRIDGENE BIOSCIENCES, INC. 2023-09-14 US disclosed
US-20220106339-A1 Methods of Making High Enantioselective Secondary Alcohols OBI PHARMA, INC. (TW) 2022-04-07 US disclosed
US-10183015-B2 Heterocyclic compounds and methods of use MEDIVATION TECHNOLOGIES LLC (US) 2019-01-22 US disclosed
EP-3038622-B1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE MEDIVATION TECH LLC (US) 2018-05-30 EP disclosed
US-20180028518-A1 Heterocyclic Compounds and Methods of Use MEDIVATION TECHNOLOGIES LLC 2018-02-01 US disclosed
US-20180028518-A1 Heterocyclic Compounds and Methods of Use MEDIVATION TECHNOLOGIES LLC 2018-02-01 US disclosed
EP-3265088-A1 SREBP BLOCKERS FOR USE IN TREATING LIVER FIBROSIS, ELEVATED CHOLESTEROL AND INSULIN RESISTANCE Medivation Technologies LLC (US) 2018-01-10 EP disclosed
US-9670172-B2 Heterocyclic compounds and methods of use MEDIVATION TECHNOLOGIES, INC. (US) 2017-06-06 US disclosed
US-20060223842-A1 such as (5-acetyl-1-methyl-1H-pyrrol-2-yl)acetyl methanesulphonamide, used for the of treatment of psoriasis, ulcerative colitis, melanoma, chronic obstructive pulmonary disease (COPD), skin disorders, rheumatoid arthritis, idiopathic fibrosis, glomerulonephritis and reperfusion injuries after ischemia DOMPÉ FARMACEUTICI S.P.A. (IT) 2006-10-05 US disclosed
WO-2005113003-A2 METHOD FOR AUGMENTING B CELL DEPLETION GENENTECH, INC. (US) 2005-12-01 WO disclosed
EP-1590314-A2 2-ARYL-ACETIC ACIDS, THEIR DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Dompe' S.P.A. (IT) 2005-11-02 EP disclosed
WO-2004069782-A2 2-ARYL-ACETIC ACIDS, THEIR DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DOMPE' S.P.A. (IT) 2004-08-19 WO disclosed
US-5155268-A Antiarrhythmic N-aminoalkylene alkyl and aryl sulfonamides THE UPJOHN COMPANY (US) 1992-10-13 US disclosed
EP-0164865-B1 N-(AMINOALKYLPHENYL)SULFONAMIDES THEIR PREPARATION AND THERAPEUTIC USE THE UPJOHN COMPANY (US) 1988-12-21 EP disclosed
EP-0164865-A1 N-(Aminoalkylphenyl)sulfonamides their preparation and therapeutic use THE UPJOHN COMPANY (US) 1985-12-18 EP disclosed
US-4490540-A FUNGICIDES, ANTITUMOR AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 1984-12-25 US disclosed
EP-0052905-B1 NOVEL (2-ARYL-4-PHENYLTHIOALKYL-1,3-DIOXOLAN-2-YL-METHYL)AZOLE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1984-10-03 EP disclosed
EP-0052905-A1 Novel (2-aryl-4-phenylthioalkyl-1,3-dioxolan-2-yl-methyl)azole derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1982-06-02 EP 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 (6 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-20220106339-A1 Methods of Making High Enantioselective Secondary Alcohols ADH5, OSTC, ADH1A KMT2A 2667/4885MAPT 3446/4885GAA 1623/4885
US-20230286904-A1 INHIBITORS OF YAP/TAZ-TEAD ONCOPROTEINS, SYNTHESIS AND USE THEREOF TEAD1, TEAD2, TEAD3 KMT2A 825/4885MAPT 433/4885GAA 3204/4885
US-20060223842-A1 such as (5-acetyl-1-methyl-1H-pyrrol-2-yl)acetyl methanesulphonamide, used for the of treatment of psoriasis, ulcerative colitis, melanoma, chronic obstructive pulmonary disease (COPD), skin disorders, rheumatoid arthritis, idiopathic fibrosis, glomerulonephritis and reperfusion injuries after ischemia CXCR2, CXCR1, MMP8 KMT2A 3815/4885MAPT 4526/4885GAA 4554/4885
US-20180028518-A1 Heterocyclic Compounds and Methods of Use LIPC, CPT1A, FABP1 KMT2A 3146/4885MAPT 4172/4885GAA 614/4885
US-11773118-B2 Methods of making high enantioselective secondary alcohols ADH5, OSTC, ADH1A KMT2A 2667/4885MAPT 3446/4885GAA 1623/4885
US-10183015-B2 Heterocyclic compounds and methods of use LIPC, CPT1A, FABP1 KMT2A 3146/4885MAPT 4172/4885GAA 614/4885

“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.