SCHEMBL4535890

SCHEMBL4535890

O=S(=O)(O)c1ccc(N=Nc2cc(F)c(O)c(F)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.59
CYP2D6 P10635 1/20 0.59
PHLPP2 Q6ZVD8 4/20 0.54
RPS6KA3 P51812 1/20 0.50
LMNA P02545 1/20 0.45
PTGS1 P23219 3/20 0.45
PTGS2 P35354 3/20 0.45
CA12 O43570 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
BRD4 O60885 1/20 0.43
ATIC P31939 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CYP2C9 P11712 3/20 0.43
GLO1 Q04760 1/20 0.43
SUMO2 P61956 1/20 0.43
SUMO1 P63165 1/20 0.43
SENP7 Q9BQF6 1/20 0.43

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
SCHEMBL4535887 1.00 POLB (0.59) POLBCYP2D6PHLPP2RPS6KA3LMNA
SCHEMBL29596405 0.86 POLB (0.56) POLBCYP2D6PHLPP2RPS6KA3LMNA
SCHEMBL4842357 0.86 POLB (0.56) POLBCYP2D6PHLPP2RPS6KA3LMNA
SCHEMBL28560987 0.82 POLB (0.83) POLBCYP2D6PHLPP2RPS6KA3LMNA
SCHEMBL18624977 0.82 POLB (0.83) POLBCYP2D6PHLPP2RPS6KA3LMNA
SCHEMBL25027696 0.80 RPS6KA3 (0.49) POLBCYP2D6PHLPP2RPS6KA3LMNA
SCHEMBL9099069 0.79 RPS6KA3 (0.55) POLBCYP2D6PHLPP2RPS6KA3LMNA
SCHEMBL4842755 0.79 RPS6KA3 (0.55) POLBCYP2D6PHLPP2RPS6KA3LMNA
SCHEMBL2171353 0.79 LMNA (0.74) POLBCYP2D6PHLPP2RPS6KA3LMNA
SCHEMBL4808253 0.79 LMNA (0.74) POLBCYP2D6PHLPP2RPS6KA3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5618726-A DYE HAVING LIGNIN-LIKE SUBSTITUTION PATTERN AND A MICROBE CAPABLE OF PRODUCING EXTRACELLULAR PEROXIDASE IDAHO RESEARCH FOUNDATION, INC. (US) 1997-04-08 US claimed
US-9645153-B2 Labeling reagents and methods of their use Life Technologies Corporation (US) 2017-05-09 US disclosed
US-20150355186-A1 Labeling Reagents and Methods of Their Use INVITROGEN CORPORATION 2015-12-10 US disclosed
US-9140706-B2 Labeling reagents and methods of their use Life Technologies Corporation (US) 2015-09-22 US disclosed
US-20130337536-A1 Labeling Reagents and Methods of Their Use Life Technologies Corporation (US) 2013-12-19 US disclosed
US-8586743-B2 Labeling reagents and methods of their use Life Technologies Corporation (US) 2013-11-19 US disclosed
US-20090004753-A1 LABELING REAGENTS AND METHODS OF THEIR USE INVITROGEN CORPORATION (US) 2009-01-01 US disclosed
WO-2006114616-A1 ENGINEERED PEROXIDASES WITH VERATRYL ALCOHOL OXIDASE ACTIVITY UNIVERSITY OF SUSSEX (GB) 2006-11-02 WO disclosed
US-5618726-A DYE HAVING LIGNIN-LIKE SUBSTITUTION PATTERN AND A MICROBE CAPABLE OF PRODUCING EXTRACELLULAR PEROXIDASE IDAHO RESEARCH FOUNDATION, INC. (US) 1997-04-08 US disclosed
US-5486214-A MONO OR DISAZO DYES, LIGNIN PEROXIDASE AND VERATRYL ALCOHOL MIXTURE FOR DEGRADATION OF DYES IDAHO RESEARCH FOUNDATION, INC. (US) 1996-01-23 US disclosed
WO-1992017550-A1 BIODEGRADABLE AZO DYES IDAHO RESEARCH FOUNDATION, INC. (US) 1992-10-15 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-20150355186-A1 Labeling Reagents and Methods of Their Use GUSB, CES2, MRPL21 POLB 1408/4885CYP2D6 180/4885PHLPP2 4534/4885

“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.