4-Nitroaniline

4-Nitroaniline

SCHEMBL3264895

C[C@H](N)C(=O)O.Nc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.64
ESR1 P03372 2/20 0.54
CYP19A1 P11511 2/20 0.54
ESR2 Q92731 2/20 0.54
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
MAPT P10636 1/20 0.53
PKM P14618 1/20 0.51
TDP1 Q9NUW8 2/20 0.48
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
SLC1A3 P43003 1/20 0.47
SLC1A2 P43004 1/20 0.47
SLC1A1 P43005 1/20 0.47
KDM4E B2RXH2 1/20 0.47
NPC1 O15118 1/20 0.47
GAA P10253 1/20 0.47
THRB P10828 1/20 0.47
ALOX12 P18054 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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 SCHEMBL5974424 1.00 ALDH1A1 (0.64) ALDH1A1ESR1CYP19A1ESR2KMT2A
4-Nitroaniline SCHEMBL3264892 1.00 ALDH1A1 (0.64) ALDH1A1ESR1CYP19A1ESR2KMT2A
4-Nitroaniline SCHEMBL10711921 1.00 ALDH1A1 (0.64) ALDH1A1ESR1CYP19A1ESR2KMT2A
4-Nitroaniline SCHEMBL29058965 0.88 ALDH1A1 (0.58) ALDH1A1ESR1CYP19A1ESR2KMT2A
Nitrobenzene SCHEMBL23406805 0.85 ALDH1A1 (0.61) ALDH1A1KMT2AMEN1TDP1TSHR
4-Nitroaniline SCHEMBL28656726 0.85 ALDH1A1 (0.75) ALDH1A1ESR1CYP19A1ESR2KMT2A
4-Nitroaniline SCHEMBL1900089 0.85 ALDH1A1 (0.75) ALDH1A1ESR1CYP19A1ESR2KMT2A
Dl-Phenylalanine SCHEMBL28464461 0.85 SLC7A5 (0.56) ALDH1A1ESR1CYP19A1ESR2KMT2A
4-Nitroaniline SCHEMBL11298826 0.85 ALDH1A1 (0.82) ALDH1A1ESR1CYP19A1ESR2KMT2A
4-Nitroaniline SCHEMBL2934038 0.84 SLC7A5 (0.53) ALDH1A1ESR1CYP19A1ESR2KMT2A

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110229091-B 1, 5-disubstituted indole derivatives with leukotriene A4 hydrolase inhibition effect and application thereof 天津科技大学 2022-11-22 CN disclosed
US-20100069504-A1 AMINOBENZOCYCLOHEPTENE DERIVATIVES, METHODS FOR PREPARING THE SAME AND USES THEREOF IN THERAPY UNIVERSITE DE HAUTE ALSACE (FR) 2010-03-18 US disclosed
EP-1042457-B1 POLYPEPTIDES HAVING AMINOPEPTIDASE ACTIVITY AND NUCLEIC ACIDS ENCODING SAME NOVOZYMES AS (DK) 2006-03-08 EP disclosed
US-6673571-B2 POLYPEPTIDE FOR USE AS TOOLS IN FOOD PROCESSING AND GENETIC ENGINEERING NOVOZYMES BIOTECH, INC. 2004-01-06 US disclosed
EP-0984703-B1 METHODS OF PRODUCING PROTEIN HYDROLYSATES NOVOZYMES BIOTECH INC (US) 2003-04-09 EP disclosed
US-20020177210-A1 Polypeptides having aminopeptidase activity and nucleic acids encoding same NOVOZYMES BIOTECH, INC. 2002-11-28 US disclosed
US-6465209-B1 MIXING WITH AMINOPEPTIDASE WITH GLYCINE RELEASING PROPERTIES; HYDROLYSIS NOVOZYMES BIOTECH, INC. 2002-10-15 US disclosed
US-6303360-B1 CULTURING SPHINGOMONAS; MOLECULAR HYBRIDIZATION; GENETIC ENGINEERING; HYDROLYZES ANILIDES OF ALANINE, GLYCINE, LEUCINE, GLUTAMIC ACID, ASPARTIC ACID, LYSINE, ISOLEUCINE, AND VALINE NOVOZYMES BIOTECH, INC, 2001-10-16 US disclosed
US-6184020-B1 AMINO ACID AND NUCLEOTIDE SEQUENCE; FOR PRODUCTION OF PROTEIN HYDROLYSATES USED AS FLAVORINGS IN FOODS NOVO NORDISK BIOTECH, INC. 2001-02-06 US disclosed
EP-1042457-A1 POLYPEPTIDES HAVING AMINOPEPTIDASE ACTIVITY AND NUCLEIC ACIDS ENCODING SAME NOVO NORDISK A/S (DK) 2000-10-11 EP disclosed
WO-1999031226-A1 POLYPEPTIDES HAVING AMINOPEPTIDASE ACTIVITY AND NUCLEIC ACIDS ENCODING SAME NOVO NORDISK A/S (DK) 1999-06-24 WO disclosed
US-5780239-A FORMING AN IMMUNOCOMPLEX WITH A LABELLED ANTIBODY SPECIFICALLY BINDING TO TAMM-HORSFALL PROTEIN; ELISA; DIPSTICKS; SPECTRUM ANALYSIS CHIMERA RESEARCH AND CHEMICAL INC. 1998-07-14 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 (1 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-20100069504-A1 AMINOBENZOCYCLOHEPTENE DERIVATIVES, METHODS FOR PREPARING THE SAME AND USES THEREOF IN THERAPY ANPEP, ENPEP, DNPEP ALDH1A1 549/4885ESR1 2198/4885CYP19A1 173/4885

“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.