SCHEMBL13382012

SCHEMBL13382012

CN(C)C(=O)Sc1nsc(OCc2cc(C(F)(F)F)ccc2F)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.39
MRGPRX4 Q96LA9 3/20 0.33
USP30 Q70CQ3 1/20 0.33
FFAR4 Q5NUL3 3/20 0.33
FFAR1 O14842 2/20 0.32
RXRA P19793 1/20 0.32
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
SRD5A2 P31213 1/20 0.32
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
JAK3 P52333 1/20 0.32
PPARA Q07869 3/20 0.32
PPARG P37231 1/20 0.32
PPARD Q03181 2/20 0.32
F2RL3 Q96RI0 1/20 0.32
FFAR2 O15552 1/20 0.32
GAA P10253 2/20 0.31
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL13382009 0.92 FFAR1 (0.40) IDO1MRGPRX4FFAR4FFAR1RXRA
SCHEMBL13382014 0.88 POLQ (0.41) RXRANR1H2NR1H3SRD5A2ALDH1A1
SCHEMBL13382005 0.88 ALKBH1 (0.36) L3MBTL1
SCHEMBL13381967 0.83 MAOB (0.41) ALDH1A1L3MBTL1
SCHEMBL13382013 0.82 NR3C2 (0.36) FFAR1F2RL3
SCHEMBL13398660 0.81 MAOA (0.34)
SCHEMBL13382008 0.80 MAOB (0.42) PPARA
SCHEMBL13398860 0.79 MAPK14 (0.32)
SCHEMBL13399643 0.78 FFAR4 (0.32) FFAR4FFAR1
SCHEMBL13382007 0.78 KMT2A (0.33) ALDH1A1L3MBTL1

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 IDO1 1716/4885MRGPRX4 448/4885USP30 2927/4885

“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.