SCHEMBL13382011

SCHEMBL13382011

CN(C)C(=O)Sc1nsc(OCc2cc(F)cc(F)c2)n1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.35
GSK3B P49841 2/20 0.33
BACE1 P56817 2/20 0.33
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 1/20 0.31
CLK1 P49759 1/20 0.31
CLK2 P49760 1/20 0.31
DYRK1A Q13627 1/20 0.31
F2RL3 Q96RI0 1/20 0.31
PAX8 Q06710 1/20 0.30
NLRP3 Q96P20 1/20 0.30
PTGS1 P23219 1/20 0.30
PTGS2 P35354 1/20 0.30

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
SCHEMBL13381961 0.89 PTGS1 (0.44) MAOBPTGS1PTGS2
SCHEMBL13381962 0.88 TDP1 (0.39) MAOBMEN1KMT2AALDH1A1PTGS1
SCHEMBL13382003 0.86 MEN1 (0.33) MEN1KMT2A
SCHEMBL13382008 0.85 MAOB (0.42) MAOBMEN1KMT2A
SCHEMBL13382025 0.85 FGFR1 (0.35) MAOBMEN1KMT2AALDH1A1
SCHEMBL13382094 0.83 ALOX5 (0.39) MAOBALDH1A1PTGS1PTGS2
SCHEMBL13381979 0.82 ALDH1A1 (0.38) MAOBMEN1KMT2AALDH1A1
SCHEMBL13381974 0.82 RXRA (0.37) MEN1KMT2AALDH1A1
SCHEMBL13382005 0.82 ALKBH1 (0.36) MAOBMEN1KMT2A
SCHEMBL13398660 0.82 MAOA (0.34) MAOBMEN1KMT2A

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 MAOB 1907/4885GSK3B 2805/4885BACE1 2767/4885

“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.