SCHEMBL6079800

SCHEMBL6079800

O=C(O)c1ccc2c(Br)ccc(O)c2n1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.53
KMT2A Q03164 2/20 0.53
KDM4A O75164 8/20 0.50
RAB9A P51151 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
MAPT P10636 1/20 0.47
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
NQO2 P16083 1/20 0.40
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
ACMSD Q8TDX5 1/20 0.39
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL8441732 0.85 KDM4E (0.59) KDM4EKMT2AKDM4ARAB9ATDP1
SCHEMBL16228318 0.79 KDM4E (0.53) KDM4EKMT2AKDM4ARAB9ATDP1
SCHEMBL16228292 0.79 KDM4E (0.64) KDM4EKMT2AKDM4ARAB9ATDP1
SCHEMBL27591912 0.78 KDM4E (0.51) KDM4EKMT2AKDM4ARAB9ATDP1
SCHEMBL18682034 0.78 KDM4E (0.58) KDM4EKMT2ARAB9ATDP1MAPT
SCHEMBL4704138 0.78 KDM4E (0.55) KDM4ERAB9ATDP1MAPTNQO2
SCHEMBL20562096 0.76 KDM4E (0.49) KDM4EKMT2ARAB9ATDP1MAPT
SCHEMBL6080627 0.76 MMP2 (0.53) KDM4EKMT2AKDM4ARAB9ATDP1
SCHEMBL9471001 0.76 COMT (0.53) KDM4EKMT2AKDM4ARAB9ATDP1
SCHEMBL6080760 0.75 KDM4E (0.56) KDM4EKMT2ARAB9ATDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NEURO3D (FR) 2006-08-17 US claimed
US-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NEURO3D (FR) 2006-08-17 US disclosed
EP-1451159-A1 COMPOSITIONS DERIVED FROM QUINOLINE AND QUINOXALINE, PREPARATION AND USE THEREOF NEURO3D (FR) 2004-09-01 EP disclosed
WO-2003010146-A1 COMPOSITIONS DERIVED FROM QUINOLINE AND QUINOXALINE, PREPARATION AND USE THEREOF NEURO3D (FR) 2003-02-06 WO 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-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NQO1, NQO2, RECQL KDM4E 1006/4885KMT2A 1384/4885KDM4A 849/4885

“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.