SCHEMBL13381964

SCHEMBL13381964

CN(C)C(=O)Sc1nsc(OCc2ccc(Cl)cc2)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
L3MBTL1 Q9Y468 3/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAOB P27338 5/20 0.39
MAOA P21397 4/20 0.39
ADORA3 P0DMS8 3/20 0.38
ADORA1 P30542 1/20 0.38
ALDH1A1 P00352 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
P2RX3 P56373 1/20 0.37
NR4A2 P43354 1/20 0.36
MAPK1 P28482 1/20 0.35
MAPT P10636 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL13381979 0.89 ALDH1A1 (0.38) KMT2AMEN1CYP1A2CYP2C9CYP2C19
SCHEMBL13381974 0.89 RXRA (0.37) KMT2AMEN1L3MBTL1ADORA3ADORA1
SCHEMBL13382000 0.88 RXRA (0.41) KMT2AMEN1L3MBTL1CYP1A2CYP2C9
SCHEMBL13381962 0.88 TDP1 (0.39) KMT2AMEN1PTGS1PTGS2MAOB
SCHEMBL13382003 0.88 MEN1 (0.33) KMT2AMEN1P2RX3MAPT
SCHEMBL13381972 0.88 MAOB (0.39) KMT2AMEN1L3MBTL1MAOBMAOA
SCHEMBL13382094 0.88 ALOX5 (0.39) PTGS1PTGS2CYP1A2CYP2C9CYP2C19
SCHEMBL13381879 0.87 ALDH1A1 (0.42) KMT2AMEN1L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL13382001 0.87 PTPRC (0.42) KMT2AMEN1CYP2C19MAOBMAOA
SCHEMBL13381995 0.87 POLB (0.41) KMT2AMEN1MAOBADORA3ADORA1

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-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 4087/4885MEN1 4525/4885L3MBTL1 818/4885

“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.