SCHEMBL472892

SCHEMBL472892

C=CCc1cc2ccccc2[nH]c1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.54
ALDH1A1 P00352 5/20 0.54
HPGD P15428 1/20 0.54
HSD17B10 Q99714 2/20 0.51
CYP1A2 P05177 1/20 0.51
MAPK1 P28482 2/20 0.50
BRD4 O60885 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
DAO P14920 1/20 0.50
DDO Q99489 1/20 0.50
IL4I1 Q96RQ9 4/20 0.49
TSHR P16473 2/20 0.48
CHEK1 O14757 1/20 0.47
KDR P35968 1/20 0.47
MAPT P10636 2/20 0.47
KMT2A Q03164 1/20 0.47
GAA P10253 1/20 0.47
HIF1A Q16665 1/20 0.47
RXFP1 Q9HBX9 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL1263927 0.79 KDM4E (0.66) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL31154599 0.79 KDM4E (0.66) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL8873594 0.77 KDM4E (0.58) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL9293635 0.77 KDM4E (0.58) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL17618004 0.77 KDM4E (0.58) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL6402311 0.77 DAO (0.59) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL30162531 0.77 KDM4E (0.58) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL6472543 0.76 MAPK1 (0.47) KDM4EALDH1A1HPGDHSD17B10CYP1A2
Hydrochloric Acid SCHEMBL17601025 0.76 KDM4E (0.56) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL28431176 0.75 BRD4 (0.53) KDM4EALDH1A1HPGDHSD17B10CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10139406-B2 Alkyl quinolones as biomarkers of pseudomonas aeruginosa infection and uses thereof THE UNIVERSITY OF NOTTINGHAM (GB) 2018-11-27 US claimed
EP-2997382-B1 ALKYL QUINOLONES AS BIOMARKERS OF PSEUDOMONAS AERUGINOSA INFECTION AND USES THEREOF UNIV NOTTINGHAM (GB) 2018-07-11 EP claimed
US-20160131648-A1 ALKYL QUINOLONES AS BIOMARKERS OF PSEUDOMONAS AERUGINOSA INFECTION AND USES THEREOF THE UNIVERSITY OF NOTTINGHAM (GB) 2016-05-12 US claimed
EP-2997382-A1 ALKYL QUINOLONES AS BIOMARKERS OF PSEUDOMONAS AERUGINOSA INFECTION AND USES THEREOF The University Of Nottingham (GB) 2016-03-23 EP claimed
WO-2014184535-A1 ALKYL QUINOLONES AS BIOMARKERS OF PSEUDOMONAS AERUGINOSA INFECTION AND USES THEREOF THE UNIVERSITY OF NOTTINGHAM (GB) 2014-11-20 WO claimed
WO-2021022066-A1 COMPOSITIONS AND METHODS FOR INHIBITING BACTERIAL VIRULENCE AND FLIM-BASED DEVICE AND METHOD FOR ANTIBIOTIC SUSCEPTIBILITY TESTING THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-02-04 WO disclosed
US-10139406-B2 Alkyl quinolones as biomarkers of pseudomonas aeruginosa infection and uses thereof THE UNIVERSITY OF NOTTINGHAM (GB) 2018-11-27 US disclosed
US-10139406-B2 Alkyl quinolones as biomarkers of pseudomonas aeruginosa infection and uses thereof THE UNIVERSITY OF NOTTINGHAM (GB) 2018-11-27 US disclosed
US-10139406-B2 Alkyl quinolones as biomarkers of pseudomonas aeruginosa infection and uses thereof THE UNIVERSITY OF NOTTINGHAM (GB) 2018-11-27 US disclosed
EP-2997382-B1 ALKYL QUINOLONES AS BIOMARKERS OF PSEUDOMONAS AERUGINOSA INFECTION AND USES THEREOF UNIV NOTTINGHAM (GB) 2018-07-11 EP disclosed
EP-2997382-B1 ALKYL QUINOLONES AS BIOMARKERS OF PSEUDOMONAS AERUGINOSA INFECTION AND USES THEREOF UNIV NOTTINGHAM (GB) 2018-07-11 EP disclosed
US-20160131648-A1 ALKYL QUINOLONES AS BIOMARKERS OF PSEUDOMONAS AERUGINOSA INFECTION AND USES THEREOF THE UNIVERSITY OF NOTTINGHAM (GB) 2016-05-12 US disclosed
US-6964973-B2 Bicyclic androgen and progesterone receptor modulator compounds and methods LIGAND PHARMACEUTICALS INCORPORATED (US) 2005-11-15 US disclosed
US-20030130505-A1 Bicyclic androgen and progesterone receptor modulator compounds and methods LIGAND PHARMACEUTICALS, INC. 2003-07-10 US disclosed
US-6566372-B1 Useful in female hormone replacement therapy and as modulators of fertility; therapy of dysfunctional uterine bleeding, dysmenorrhea, endometriosis, leiomyomas (uterine fibroids), hot flashes, mood disorders, meningiomas, cancer LIGAND PHARMACEUTICALS INCORPORATED 2003-05-20 US disclosed
EP-1212303-A2 BICYCLIC ANDROGEN AND PROGESTERONE RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS INCORPORATED (US) 2002-06-12 EP disclosed
WO-2001016108-A2 BICYCLIC ANDROGEN AND PROGESTERONE RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS INCORPORATED (US) 2001-03-08 WO disclosed
US-4049811-A MICROBIOCIDES BOEHRINGER MANNHEIM G.M.B.H. (DT) 1977-09-20 US disclosed
US-3988460-A Cyclopentenoquinolone compounds for treating bacterial infections BOEHRINGER MANNHEIM G.M.B.H. (DT) 1976-10-26 US disclosed
US-3966743-A ANTIMICROBIAL BOEHRINGER MANNHEIM G.M.B.H. (DT) 1976-06-29 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-20160131648-A1 ALKYL QUINOLONES AS BIOMARKERS OF PSEUDOMONAS AERUGINOSA INFECTION AND USES THEREOF NQO2, QARS1, CD14 KDM4E 4049/4885ALDH1A1 1222/4885HPGD 126/4885
US-10139406-B2 Alkyl quinolones as biomarkers of pseudomonas aeruginosa infection and uses thereof NQO2, QARS1, CD14 KDM4E 4049/4885ALDH1A1 1222/4885HPGD 126/4885
US-20030130505-A1 Bicyclic androgen and progesterone receptor modulator compounds and methods AR, NR5A1, PGR KDM4E 2209/4885ALDH1A1 2131/4885HPGD 283/4885

“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.