SCHEMBL13381990

SCHEMBL13381990

COc1ccccc1COc1nc(SC(=O)N(C)C)ns1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.39
POLB P06746 2/20 0.37
PARP14 Q460N5 1/20 0.37
PARP10 Q53GL7 1/20 0.37
MEN1 O00255 4/20 0.37
CYP1A2 P05177 2/20 0.37
CYP2C19 P33261 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
USP2 O75604 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
TSHR P16473 1/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ABCB1 P08183 1/20 0.36
MAOB P27338 1/20 0.36
ALKBH1 Q13686 1/20 0.36
IDO1 P14902 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL13381983 0.91 L3MBTL1 (0.40) KMT2AMEN1NPSR1USP2TSHR
SCHEMBL13382021 0.88 ALDH1A1 (0.42) KMT2APOLBMEN1TSHRMAPT
SCHEMBL13381967 0.85 MAOB (0.41) KMT2APARP14PARP10MEN1TSHR
SCHEMBL13381973 0.85 IDO1 (0.33) IDO1
SCHEMBL13381968 0.85 MAOB (0.41) KMT2AMEN1MAPTMAOBKDM4E
SCHEMBL13381966 0.85 ALDH1A1 (0.39) KMT2APOLBPARP10MEN1TSHR
SCHEMBL13398887 0.85 RAB9A (0.31) TSHRSMN1; SMN2
SCHEMBL13382094 0.82 ALOX5 (0.39) CYP1A2CYP2C19CYP3A4CYP2D6TSHR
SCHEMBL13382098 0.82 PARP10 (0.39) PARP10CYP1A2TSHRSMN1; SMN2MAOB
SCHEMBL13382005 0.81 ALKBH1 (0.36) KMT2AMEN1MAOBALKBH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100081693-A1 THIADIAZOLE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-01 US disclosed
US-20100081693-A1 THIADIAZOLE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-01 US disclosed
WO-2008032858-A2 THIADIAZOLE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-03-20 WO 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-20100081693-A1 THIADIAZOLE COMPOUND AND USE THEREOF NR2C2, NR4A3, NR0B2 KMT2A 4087/4885POLB 4566/4885PARP14 2449/4885

“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.