SCHEMBL10085276

SCHEMBL10085276

C=CCOC(=O)Nc1nc(CC)cs1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.50
TSHR P16473 2/20 0.50
CSNK2A2 P19784 1/20 0.44
CSNK2A1 P68400 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 3/20 0.43
MAPT P10636 4/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
LMNA P02545 3/20 0.43
ALDH1A1 P00352 1/20 0.42
HTT P42858 1/20 0.42
POLB P06746 1/20 0.41
TP53 P04637 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL13609546 0.86 MAPK1 (0.69) MAPK1TSHRSMN1; SMN2GAAKMT2A
SCHEMBL4255395 0.85 MAPK1 (0.49) MAPK1TSHRCSNK2A2CSNK2A1SMN1; SMN2
SCHEMBL91587 0.82 MAPK1 (0.63) MAPK1TSHRCSNK2A2CSNK2A1SMN1; SMN2
SCHEMBL13609557 0.81 CYP1A2 (0.64) MAPK1TSHRSMN1; SMN2GAAMAPT
SCHEMBL10078987 0.80 ATAD2 (0.50) MAPK1TSHRSMN1; SMN2GAAKMT2A
SCHEMBL27871368 0.80 MAPK1 (0.40) MAPK1TSHRCSNK2A2CSNK2A1SMN1; SMN2
SCHEMBL6922805 0.80 CSNK2A2 (0.45) MAPK1TSHRCSNK2A2CSNK2A1SMN1; SMN2
SCHEMBL10081941 0.80 MAPK1 (0.57) MAPK1TSHRCSNK2A2CSNK2A1SMN1; SMN2
SCHEMBL4255385 0.80 L3MBTL1 (0.54) MAPK1TSHRCSNK2A2CSNK2A1SMN1; SMN2
SCHEMBL10084294 0.79 KMT2A (0.47) MAPK1SMN1; SMN2GAAKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119645-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2012-02-21 US disclosed
US-20090291969-A1 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2009-11-26 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 (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-20090291969-A1 Fungicide hydroximoyl-tetrazole derivatives HAAO, HAO1, CYP51A1 MAPK1 2690/4885TSHR 1467/4885CSNK2A2 2736/4885

“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.