SCHEMBL935534

SCHEMBL935534

N#Cc1nc2cc(O)c(Cl)cc2s1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PSMB8 P28062 2/20 0.45
PGK1 P00558 1/20 0.41
HSD17B10 Q99714 9/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
DYRK1A Q13627 1/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32

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
SCHEMBL12908841 0.80 PSMB8 (0.45) PSMB8PGK1HSD17B10HPGDTSHR
SCHEMBL31215702 0.80 PSMB8 (0.35) PSMB8DYRK1AESR1ESR2
SCHEMBL9796864 0.80 PSMB8 (0.44) PSMB8HSD17B10HPGDTSHRDYRK1A
SCHEMBL1046655 0.77 PSMB8 (0.35) PSMB8DYRK1AESR1ESR2
SCHEMBL12908846 0.77 GAA (0.42) PSMB8HSD17B10HPGDTSHRDYRK1A
SCHEMBL31694405 0.77 PSMB8 (0.35) PSMB8HSD17B10DYRK1A
SCHEMBL935080 0.76 PGK1 (0.47) PSMB8PGK1
SCHEMBL935857 0.73 AKR1B1 (0.38) PSMB8HSD17B10HPGD
SCHEMBL12312873 0.73 PGK1 (0.47) PSMB8PGK1
SCHEMBL140656 0.72 HTT (0.56) DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2454329-B1 FLUORESCENT DYES AND USES THEREOF BECKMAN COULTER INC (US) 2018-04-18 EP disclosed
EP-2454329-B1 FLUORESCENT DYES AND USES THEREOF BECKMAN COULTER INC (US) 2018-04-18 EP disclosed
US-8772501-B2 Fluorescent dyes and uses thereof BECKMAN COULTER, INC. (US) 2014-07-08 US disclosed
US-8772501-B2 Fluorescent dyes and uses thereof BECKMAN COULTER, INC. (US) 2014-07-08 US disclosed
US-8772501-B2 Fluorescent dyes and uses thereof BECKMAN COULTER, INC. (US) 2014-07-08 US disclosed
US-20130131324-A1 Novel Fluorescent Dyes and Uses Thereof BECKMAN COULTER, INC. (US) 2013-05-23 US disclosed
US-20130131324-A1 Novel Fluorescent Dyes and Uses Thereof BECKMAN COULTER, INC. (US) 2013-05-23 US disclosed
US-20130131324-A1 Novel Fluorescent Dyes and Uses Thereof BECKMAN COULTER, INC. (US) 2013-05-23 US disclosed
US-8367842-B2 Fluorescent dyes and uses thereof BECKMAN COULTER, INC. (US) 2013-02-05 US disclosed
US-8367842-B2 Fluorescent dyes and uses thereof BECKMAN COULTER, INC. (US) 2013-02-05 US disclosed
US-8367842-B2 Fluorescent dyes and uses thereof BECKMAN COULTER, INC. (US) 2013-02-05 US disclosed
EP-2454329-A1 NOVEL FLUORESCENT DYES AND USES THEREOF Beckman Coulter, Inc. (US) 2012-05-23 EP disclosed
WO-2011008912-A1 NOVEL FLUORESCENT DYES AND USES THEREOF BECKMAN COULTER, INC. (US) 2011-01-20 WO disclosed
US-20110014599-A1 Novel Fluorescent Dyes and Uses Thereof BECKMAN COULTER, INC. (US) 2011-01-20 US disclosed
WO-2011008912-A1 NOVEL FLUORESCENT DYES AND USES THEREOF BECKMAN COULTER, INC. (US) 2011-01-20 WO disclosed
US-20110014599-A1 Novel Fluorescent Dyes and Uses Thereof BECKMAN COULTER, INC. (US) 2011-01-20 US disclosed
US-20110014599-A1 Novel Fluorescent Dyes and Uses Thereof BECKMAN COULTER, INC. (US) 2011-01-20 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 (2 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-20130131324-A1 Novel Fluorescent Dyes and Uses Thereof GUSB, CHLSN, NQO1 PSMB8 4479/4885PGK1 4522/4885HSD17B10 1162/4885
US-20110014599-A1 Novel Fluorescent Dyes and Uses Thereof GUSB, CHLSN, NQO1 PSMB8 4479/4885PGK1 4522/4885HSD17B10 1162/4885

“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.