SCHEMBL4066150

SCHEMBL4066150

Cc1c(-c2csc(Nc3ccc(Oc4ccccc4)cc3)n2)cnn1-c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 3/20 0.57
PTGS2 P35354 3/20 0.54
AMY1A P0DUB6 1/20 0.51
PTGES O14684 1/20 0.49
MAPT P10636 6/20 0.49
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
SMN1; SMN2 Q16637 5/20 0.49
GAA P10253 4/20 0.49
RAB9A P51151 4/20 0.49
ALOX5 P09917 2/20 0.49
NFKB1 P19838 2/20 0.49
NFKB2 Q00653 2/20 0.49
RELA Q04206 2/20 0.49
RECQL P46063 1/20 0.49
ABL1 P00519 1/20 0.48
BCR P11274 1/20 0.48
ALDH1A1 P00352 3/20 0.46
NPC1 O15118 3/20 0.46
MCL1 Q07820 1/20 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
SCHEMBL4241367 0.92 AMY1A (0.62) PLAUPTGS2AMY1AMAPTMEN1
SCHEMBL4239559 0.90 PLAU (0.52) PLAUPTGS2AMY1AMAPTMEN1
SCHEMBL4233688 0.89 MEN1 (0.50) PLAUPTGS2AMY1AMAPTMEN1
SCHEMBL4242424 0.87 ALOX5 (0.54) PLAUPTGS2AMY1AMAPTMEN1
SCHEMBL4067193 0.87 VCP (0.57) PLAUAMY1APTGESMAPTMEN1
SCHEMBL4065329 0.84 PKM (0.47) PLAUPTGS2AMY1AMAPTMEN1
SCHEMBL12298170 0.83 MAPT (0.54) PLAUAMY1AMAPTMEN1KMT2A
SCHEMBL12297213 0.82 AMY1A (0.42) PLAUPTGS2AMY1AMAPTMEN1
SCHEMBL4243912 0.80 MEN1 (0.52) PLAUAMY1AMAPTMEN1KMT2A
SCHEMBL4057215 0.80 CYP1A2 (0.54) PLAUMAPTMEN1KMT2ASMN1; SMN2

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-8017629-B2 Compounds and uses thereof in modulating amyloid β NEUROGENETIC PHARMACEUTICALS, INC. (US) 2011-09-13 US disclosed
US-8017629-B2 Compounds and uses thereof in modulating amyloid β NEUROGENETIC PHARMACEUTICALS, INC. (US) 2011-09-13 US disclosed
US-20100324032-A1 COMPOUNDS AND USES THEREOF IN MODULATING AMYLOID BETA NEUROGENETIC PHARMACEUTICALS, INC. 2010-12-23 US disclosed
US-20100324032-A1 COMPOUNDS AND USES THEREOF IN MODULATING AMYLOID BETA NEUROGENETIC PHARMACEUTICALS, INC. 2010-12-23 US disclosed
US-7781442-B2 Compounds and uses thereof in modulating amyloid beta NEUROGENETIC PHARMACEUTICALS, INC. (US) 2010-08-24 US disclosed
US-7781442-B2 Compounds and uses thereof in modulating amyloid beta NEUROGENETIC PHARMACEUTICALS, INC. (US) 2010-08-24 US disclosed
WO-2009010871-A2 PYRAZOLE DERIVATIVES AS ANTAGONISTS OF ADENOSINE A3 RECEPTOR ADDEX PHARMA S.A. (CH) 2009-01-22 WO disclosed
US-20070260058-A1 Compounds and Uses Thereof in Modulating Amyloid Beta TORREYPINES THERAPEUTICS INC. 2007-11-08 US disclosed
US-20070260058-A1 Compounds and Uses Thereof in Modulating Amyloid Beta TORREYPINES THERAPEUTICS INC. 2007-11-08 US disclosed
US-7244739-B2 Compounds and uses thereof in modulating amyloid beta TORREYPINES THERAPEUTICS, INC. (US) 2007-07-17 US disclosed
US-7244739-B2 Compounds and uses thereof in modulating amyloid beta TORREYPINES THERAPEUTICS, INC. (US) 2007-07-17 US 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 (2 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-20100324032-A1 COMPOUNDS AND USES THEREOF IN MODULATING AMYLOID BETA APP, BACE1, BACE2 PLAU 1918/4885PTGS2 2353/4885AMY1A 169/4885
US-20070260058-A1 Compounds and Uses Thereof in Modulating Amyloid Beta APP, BACE1, BACE2 PLAU 1918/4885PTGS2 2353/4885AMY1A 169/4885

“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.