SCHEMBL14565634

SCHEMBL14565634

O=C(O)c1ccc2nc(-c3ccc(F)cc3)c(-c3ccc(F)cc3)nc2c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.73
GAA P10253 3/20 0.73
RAB9A P51151 3/20 0.73
KDM4E B2RXH2 2/20 0.73
HPGD P15428 2/20 0.73
NPC1 O15118 2/20 0.73
SMN1; SMN2 Q16637 1/20 0.73
MAPT P10636 3/20 0.72
CDH1 P12830 1/20 0.72
APC P25054 1/20 0.72
CTNNB1 P35222 1/20 0.72
TCF7L2 Q9NQB0 1/20 0.72
CSNK2A2 P19784 1/20 0.60
CSNK2B P67870 1/20 0.60
NR4A2 P43354 1/20 0.57
TDP1 Q9NUW8 1/20 0.56
BCL2L1 Q07817 1/20 0.55
BAD Q92934 1/20 0.55
NAMPT P43490 8/20 0.54
MEN1 O00255 3/20 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
SCHEMBL17184420 0.90 CDH1 (0.68) ALDH1A1GAARAB9AKDM4EHPGD
SCHEMBL23416437 0.86 RPS6KB2 (0.64) ALDH1A1GAARAB9AKDM4EHPGD
SCHEMBL17184408 0.86 CDH1 (0.70) ALDH1A1GAARAB9AKDM4EHPGD
SCHEMBL18995965 0.86 KDM4E (0.57) ALDH1A1GAARAB9AKDM4EHPGD
SCHEMBL17184412 0.86 CDH1 (0.57) ALDH1A1GAARAB9AKDM4EHPGD
SCHEMBL15665863 0.85 HPGD (0.93) ALDH1A1GAARAB9AKDM4EHPGD
SCHEMBL15666427 0.85 HPGD (0.93) ALDH1A1GAARAB9AKDM4EHPGD
SCHEMBL1258992 0.85 ALDH1A1 (0.76) ALDH1A1GAARAB9AKDM4EHPGD
SCHEMBL6291531 0.85 ALDH1A1 (1.00) ALDH1A1GAARAB9AKDM4EHPGD
SCHEMBL30555665 0.85 ALDH1A1 (1.00) ALDH1A1GAARAB9AKDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230310424-A1 METHODS AND MATERIALS FOR INCREASING NICOTINAMIDE PHOSPHORIBOSYL TRANSFERASE ACTIVITY UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2023-10-05 US disclosed
US-20230310424-A1 METHODS AND MATERIALS FOR INCREASING NICOTINAMIDE PHOSPHORIBOSYL TRANSFERASE ACTIVITY UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2023-10-05 US disclosed
US-20230041576-A1 METHODS AND MATERIALS FOR INHIBITING NF-kB ACTIVITY UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2023-02-09 US disclosed
WO-2022109311-A1 METHODS AND MATERIALS FOR INCREASING NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE ACTIVITY UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2022-05-27 WO disclosed
WO-2021102370-A1 METHODS AND MATERIALS FOR INHIBITING NF-kB ACTIVITY UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2021-05-27 WO disclosed
US-10144742-B2 Quinoxaline compounds and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2018-12-04 US disclosed
US-20170174704-A1 QUINOXALINE COMPOUNDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2017-06-22 US disclosed
US-20170174704-A1 QUINOXALINE COMPOUNDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2017-06-22 US disclosed
US-20170174704-A1 QUINOXALINE COMPOUNDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2017-06-22 US disclosed
EP-3131881-A1 QUINOXALINE COMPOUNDS AND USES THEREOF Millennium Pharmaceuticals, Inc. (US) 2017-02-22 EP disclosed
WO-2015161142-A1 QUINOXALINE COMPOUNDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-10-22 WO disclosed
WO-2015161142-A1 QUINOXALINE COMPOUNDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-10-22 WO disclosed
US-20150141422-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK BIOENERGENIX, LLC 2015-05-21 US disclosed
US-20150141422-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK BIOENERGENIX, LLC 2015-05-21 US disclosed
US-20150141422-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK BIOENERGENIX, LLC 2015-05-21 US disclosed
US-20140128392-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK BIOENERGENIX (US) 2014-05-08 US disclosed
US-20140128392-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK BIOENERGENIX (US) 2014-05-08 US disclosed
US-20140128392-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK BIOENERGENIX (US) 2014-05-08 US disclosed
US-7189724-B2 Quinoxaline derivatives having antiviral activity VALEANT RESEARCH AND DEVELOPMENT (US) 2007-03-13 US disclosed
US-7189724-B2 Quinoxaline derivatives having antiviral activity VALEANT RESEARCH AND DEVELOPMENT (US) 2007-03-13 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 (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-20230310424-A1 METHODS AND MATERIALS FOR INCREASING NICOTINAMIDE PHOSPHORIBOSYL TRANSFERASE ACTIVITY NAMPT, NNMT, NAPRT ALDH1A1 1726/4885GAA 235/4885RAB9A 1946/4885
US-10144742-B2 Quinoxaline compounds and uses thereof NAMPT, NQO2, NNMT ALDH1A1 1374/4885GAA 3128/4885RAB9A 787/4885
US-20230041576-A1 METHODS AND MATERIALS FOR INHIBITING NF-kB ACTIVITY NFKBIA, IKBKB, NFKB2 ALDH1A1 4286/4885GAA 403/4885RAB9A 2742/4885
US-20170174704-A1 QUINOXALINE COMPOUNDS AND USES THEREOF NAMPT, NQO2, NNMT ALDH1A1 1374/4885GAA 3128/4885RAB9A 787/4885
US-20150141422-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK PASK, PDXK, PANK2 ALDH1A1 3714/4885GAA 306/4885RAB9A 983/4885
US-20140128392-A1 HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK PASK, PDXK, PANK2 ALDH1A1 3255/4885GAA 423/4885RAB9A 870/4885

“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.