SCHEMBL3336657

SCHEMBL3336657

Cc1ccc(O)c(N=N)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.58
LMNA P02545 5/20 0.58
KDM4E B2RXH2 4/20 0.58
HTT P42858 4/20 0.58
NPC1 O15118 4/20 0.57
RAB9A P51151 4/20 0.57
FTO Q9C0B1 1/20 0.53
TRPA1 O75762 1/20 0.52
L3MBTL1 Q9Y468 4/20 0.51
MAPK1 P28482 3/20 0.51
TDP1 Q9NUW8 4/20 0.50
TP53 P04637 3/20 0.50
ALDH1A1 P00352 5/20 0.46
ALOX15 P16050 3/20 0.46
HSD17B10 Q99714 3/20 0.46
THRB P10828 1/20 0.46
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
GAA P10253 3/20 0.46
POLB P06746 2/20 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
SCHEMBL7913514 0.81 NPC1 (0.80) MAPTLMNAKDM4EHTTNPC1
SCHEMBL8204503 0.81 NPC1 (0.80) MAPTLMNAKDM4EHTTNPC1
SCHEMBL3336655 0.77 NPC1 (0.57) MAPTLMNAKDM4EHTTNPC1
SCHEMBL1031711 0.77 MAPT (0.58) MAPTLMNAKDM4EHTTNPC1
SCHEMBL17771965 0.77 NPC1 (0.57) MAPTLMNAKDM4EHTTNPC1
SCHEMBL23511143 0.77 FTO (0.79) MAPTLMNAKDM4EHTTNPC1
SCHEMBL12565720 0.77 FTO (0.79) MAPTLMNAKDM4EHTTNPC1
SCHEMBL1485811 0.76 TDP1 (0.42) MAPTLMNAKDM4EHTTNPC1
SCHEMBL16434726 0.76 FTO (0.56) MAPTLMNAKDM4EHTTNPC1
SCHEMBL14538303 0.73 NPC1 (0.57) MAPTLMNAKDM4EHTTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5326697-A NAD, hydroxybutyrate dehydrogenase, cystine reductase, cystine indicator dye MILES INC. (US) 1994-07-05 US claimed
EP-0348826-B1 Isobenzothiazolone chromogenic thiol indicators and their derivatives MILES INC (US) 1994-04-13 EP claimed
US-5187265-A Medical diagnosis MILES INC. (US) 1993-02-16 US claimed
US-5187105-A Process for determining thiols using chromogenic benzoisothiazolone derivatives MILES INC. (US) 1993-02-16 US claimed
US-5128457-A Medical diagnosis MILES INC. (US) 1992-07-07 US claimed
EP-0348826-A2 Isobenzothiazolone chromogenic thiol indicators and their derivatives MILES INC. (US) 1990-01-03 EP claimed
US-20180311237-A1 COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING MUCOSITIS AND WEIGHT LOSS ZPNE GROUP GMBH (CH) 2018-11-01 US disclosed
US-20150031701-A1 COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING MUCOSITIS AND WEIGHT LOSS ZPNE GROUP GMBH (CH) 2015-01-29 US disclosed
US-20130259930-A1 Compositions and Methods for Preventing and Treating Mucositis and Weight Loss CASCADE ESTATE LTD. (MU) 2013-10-03 US disclosed
US-20120196825-A1 COMPOSITIONS AND METHODS FOR MODULATING THE IMMUNE SYSTEM SUPPORTIVE THERAPEUTICS AG (CH) 2012-08-02 US disclosed
US-20100092547-A1 COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING MUCOSITIS AND WEIGHT LOSS ZPNE GROUP GMBH (CH) 2010-04-15 US disclosed
EP-2134347-A2 COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING MUCOSITIS AND WEIGHT LOSS Prendergast, Patrick T. (AU) 2009-12-23 EP disclosed
US-20090156546-A1 Compositions and methods for modulating the immune system SUPPORTIVE THERAPEUTICS AG (CH) 2009-06-18 US disclosed
US-5190863-A Composition for determining the presence or concentration of D-β-hydroxybutyrate MILES INC. (US) 1993-03-02 US disclosed
US-5187265-A Medical diagnosis MILES INC. (US) 1993-02-16 US disclosed
US-5187105-A Process for determining thiols using chromogenic benzoisothiazolone derivatives MILES INC. (US) 1993-02-16 US disclosed
US-5130433-A Indicators for detection of thiol MILES INC. (US) 1992-07-14 US disclosed
US-5128457-A Medical diagnosis MILES INC. (US) 1992-07-07 US disclosed
EP-0463524-A1 Composition and method of assaying for ketone bodies Bayer Corporation (US) 1992-01-02 EP disclosed
EP-0348826-A2 Isobenzothiazolone chromogenic thiol indicators and their derivatives MILES INC. (US) 1990-01-03 EP 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-20180311237-A1 COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING MUCOSITIS AND WEIGHT LOSS SI, MTPN, MUC1 MAPT 4455/4885LMNA 1232/4885KDM4E 2898/4885
US-20100092547-A1 COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING MUCOSITIS AND WEIGHT LOSS MTAP, TPMT, MUC1 MAPT 4845/4885LMNA 2322/4885KDM4E 3627/4885
US-20150031701-A1 COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING MUCOSITIS AND WEIGHT LOSS SI, MTPN, MUC1 MAPT 4455/4885LMNA 1232/4885KDM4E 2898/4885
US-20130259930-A1 Compositions and Methods for Preventing and Treating Mucositis and Weight Loss SI, MTPN, MUC1 MAPT 4455/4885LMNA 1232/4885KDM4E 2898/4885
US-20090156546-A1 Compositions and methods for modulating the immune system MRE11, XPA, MPL MAPT 4639/4885LMNA 2572/4885KDM4E 3900/4885
US-20120196825-A1 COMPOSITIONS AND METHODS FOR MODULATING THE IMMUNE SYSTEM MRE11, XPA, MPL MAPT 4639/4885LMNA 2572/4885KDM4E 3900/4885

“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.