SCHEMBL2074140

SCHEMBL2074140

c1ccc2sc(-n3cnnn3)nc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.51
NPC1 O15118 6/20 0.46
RAB9A P51151 6/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NOTUM Q6P988 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KAT2A Q92830 1/20 0.44
KAT2B Q92831 1/20 0.44
MAPK1 P28482 1/20 0.44
HPGD P15428 2/20 0.44
MAPT P10636 1/20 0.44
CYP1A2 P05177 1/20 0.43
POLB P06746 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
ALDH1A1 P00352 3/20 0.42
NPSR1 Q6W5P4 3/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL23360634 0.77 NPC1 (0.46) HSD17B10NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL11375551 0.75 RAB9A (0.51) HSD17B10NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL5324725 0.71 ALDH1A1 (0.50) HSD17B10NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9007952 0.71 HSD17B10 (0.50) HSD17B10NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL18741279 0.70 RAB9A (0.46) HSD17B10NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL18321230 0.70 MAPT (0.70) HSD17B10NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9465324 0.69 RAB9A (0.53) HSD17B10NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL10489897 0.68 RAB9A (0.65) HSD17B10NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL5884131 0.68 MEN1 (0.52) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL827403 0.67 RAB9A (0.67) HSD17B10NPC1RAB9ASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102643274-B Water-soluble tetrazolium salts BAYER HEALTHCARE LLC 2015-02-18 CN disclosed
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-0476457-B1 2-Benzothiazolyl tetrazolium salt indicators BAYER AG (US) 1996-12-04 EP disclosed
EP-0476457-A2 2-Benzothiazolyl tetrazolium salt indicators Bayer Corporation (US) 1992-03-25 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 HSD17B10 1379/4885NPC1 3854/4885RAB9A 4487/4885

“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.