SCHEMBL3304702

SCHEMBL3304702

[N]=Nc1ccc(O)c2ncccc12

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.70
L3MBTL1 Q9Y468 7/20 0.70
KDM4E B2RXH2 7/20 0.70
TDP1 Q9NUW8 5/20 0.70
NPC1 O15118 5/20 0.70
RAB9A P51151 4/20 0.70
ALDH1A1 P00352 2/20 0.70
XBP1 P17861 1/20 0.70
NPSR1 Q6W5P4 1/20 0.70
GLO1 Q04760 3/20 0.62
MEN1 O00255 9/20 0.59
KMT2A Q03164 9/20 0.59
HTT P42858 6/20 0.59
LMNA P02545 5/20 0.59
SMN1; SMN2 Q16637 5/20 0.59
MAPK1 P28482 4/20 0.59
OPRK1 P41145 2/20 0.59
KCNH2 Q12809 1/20 0.57
HSP90AA1 P07900 5/20 0.56
MPI P34949 1/20 0.56

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
SCHEMBL6709708 0.82 MAPT (0.70) MAPTL3MBTL1KDM4ETDP1NPC1
SCHEMBL105461 0.82 L3MBTL1 (1.00) MAPTL3MBTL1KDM4ETDP1NPC1
SCHEMBL29624594 0.82 L3MBTL1 (1.00) MAPTL3MBTL1KDM4ETDP1NPC1
Hydrochloric Acid SCHEMBL6865586 0.81 L3MBTL1 (0.97) MAPTL3MBTL1KDM4ETDP1NPC1
SCHEMBL31157828 0.81 L3MBTL1 (0.97) MAPTL3MBTL1KDM4ETDP1NPC1
SCHEMBL5851373 0.79 GLO1 (0.88) MAPTL3MBTL1KDM4ETDP1NPC1
SCHEMBL5851384 0.79 GLO1 (0.88) MAPTL3MBTL1KDM4ETDP1NPC1
SCHEMBL1920452 0.78 KDM4E (0.70) MAPTL3MBTL1KDM4ETDP1NPC1
SCHEMBL8531824 0.78 MEN1 (0.76) MAPTL3MBTL1KDM4ETDP1NPC1
SCHEMBL15290177 0.78 MAPT (0.64) MAPTL3MBTL1KDM4ETDP1NPC1

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 26 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
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
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
EP-2026810-A2 COMPOSITIONS AND METHODS FOR MODULATING THE IMMUNE SYSTEM Prendergast, Patrick T. (AU) 2009-02-25 EP disclosed
US-5326697-A NAD, hydroxybutyrate dehydrogenase, cystine reductase, cystine indicator dye MILES INC. (US) 1994-07-05 US disclosed
EP-0348826-B1 Isobenzothiazolone chromogenic thiol indicators and their derivatives MILES INC (US) 1994-04-13 EP 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

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 4455/4885L3MBTL1 1338/4885KDM4E 2898/4885
US-20100092547-A1 COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING MUCOSITIS AND WEIGHT LOSS MTAP, TPMT, MUC1 MAPT 4845/4885L3MBTL1 1262/4885KDM4E 3627/4885
US-20150031701-A1 COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING MUCOSITIS AND WEIGHT LOSS SI, MTPN, MUC1 MAPT 4455/4885L3MBTL1 1338/4885KDM4E 2898/4885
US-20130259930-A1 Compositions and Methods for Preventing and Treating Mucositis and Weight Loss SI, MTPN, MUC1 MAPT 4455/4885L3MBTL1 1338/4885KDM4E 2898/4885
US-20090156546-A1 Compositions and methods for modulating the immune system MRE11, XPA, MPL MAPT 4639/4885L3MBTL1 2069/4885KDM4E 3900/4885
US-20120196825-A1 COMPOSITIONS AND METHODS FOR MODULATING THE IMMUNE SYSTEM MRE11, XPA, MPL MAPT 4639/4885L3MBTL1 2069/4885KDM4E 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.