SCHEMBL2073804

SCHEMBL2073804

NNc1nc(C(F)F)c(Cl)s1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.39
MEN1 O00255 6/20 0.39
KMT2A Q03164 6/20 0.39
LMNA P02545 5/20 0.39
KDM4E B2RXH2 3/20 0.39
POLB P06746 2/20 0.39
ALDH1A1 P00352 5/20 0.36
GAA P10253 4/20 0.36
TDP1 Q9NUW8 4/20 0.36
RAB9A P51151 3/20 0.36
PKM P14618 3/20 0.36
NPC1 O15118 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MAPK1 P28482 2/20 0.36
ALOX12 P18054 2/20 0.36
IDO1 P14902 2/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
GFER P55789 1/20 0.33

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
SCHEMBL8808010 0.93 MEN1 (0.35) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL8807303 0.72
SCHEMBL3810678 0.68 MAPT (0.39) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL3817613 0.64 GAA (0.43) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL9505628 0.56 SMN1; SMN2 (0.53) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL11376019 0.54 MEN1 (0.33) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL8807708 0.52
SCHEMBL11697181 0.52
SCHEMBL20144683 0.51 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL31419166 0.51 MEN1 (0.37) MAPTMEN1KMT2AALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1851215-B1 WATER-SOLUBLE TETRAZOLIUM SALTS BAYER HEALTHCARE LLC (US) 2013-12-18 EP disclosed
CN-102643274-A Water-soluble tetrazolium salts BAYER HEALTHCARE LLC 2012-08-22 CN disclosed
US-7897331-B2 Process of using a tetrazolium salt BAYER HEALTHCARE LLC (US) 2011-03-01 US disclosed
US-20100255506-A1 PROCESS OF USING A TETRAZOLIUM SALT BAYER HEALTHCARE LLC (US) 2010-10-07 US disclosed
US-7767822-B2 Water-soluble tetrazolium salts BAYER HEALTHCARE LLC (US) 2010-08-03 US disclosed
US-20080125471-A1 Water-Soluble Tetrazolium Salts ASCENSIA DIABETES CARE HOLDINGS AG (CH) 2008-05-29 US disclosed
CN-101115750-A Water soluble tetrazolium salts BAYER HEALTHCARE LLC (US) 2008-01-30 CN disclosed
EP-1851215-A1 WATER-SOLUBLE TETRAZOLIUM SALTS Bayer Healthcare, LLC (US) 2007-11-07 EP disclosed
WO-2006076619-A1 WATER-SOLUBLE TETRAZOLIUM SALTS BAYER HEALTHCARE LLC (US) 2006-07-20 WO disclosed
EP-0476456-B1 Substituted 2-thiazolyl tetrazolium salt indicators BAYER AG (US) 1997-11-12 EP disclosed
EP-0476454-B1 Analytical method using tetrazolium salt indicators having a reflectance plateau BAYER AG (US) 1996-10-23 EP disclosed
US-5322680-A Chromogenic detector for medical diagnosis by forming formazan dyes chemical reduction MILES INC. (US) 1994-06-21 US disclosed
EP-0432563-B1 4-Substituted-5-chloro-2-hydrazino thiazols BAYER AG (DE) 1994-03-09 EP disclosed
US-5126275-A Chromogenic reducing indicators for reducing substances such as NADH MILES INC. (US) 1992-06-30 US disclosed
EP-0476454-A1 Analytical method using tetrazolium salt indicators having a reflectance plateau Bayer Corporation (US) 1992-03-25 EP disclosed
EP-0476456-A2 Substituted 2-thiazolyl tetrazolium salt indicators Bayer Corporation (US) 1992-03-25 EP disclosed
US-5068343-A Fungicides for plants BAYER AKTIENGESELLSCHAFT (DE) 1991-11-26 US disclosed
EP-0432563-A2 4-Substituted-5-chloro-2-hydrazino thiazols BAYER AG (DE) 1991-06-19 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 (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-20080125471-A1 Water-Soluble Tetrazolium Salts TST, AASDHPPT, APRT MAPT 330/4885MEN1 4265/4885KMT2A 443/4885

“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.