SCHEMBL5378135

SCHEMBL5378135

CSc1nsc(OCc2cccc(C(F)(F)F)c2)n1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.46
IDO1 P14902 2/20 0.46
MAOA P21397 1/20 0.44
NR4A2 P43354 2/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
MAPT P10636 2/20 0.42
HTT P42858 1/20 0.42
FFAR4 Q5NUL3 2/20 0.40
POLB P06746 1/20 0.40
FFAR1 O14842 1/20 0.40
ALDH1A1 P00352 2/20 0.40
GAA P10253 2/20 0.40
HCAR2 Q8TDS4 1/20 0.40
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL5373469 0.85 MAOB (0.41) MAOBIDO1L3MBTL1POLBKDM4E
SCHEMBL5381819 0.76 KMT2A (0.52) MAOBMAOAL3MBTL1MAPTHTT
SCHEMBL5377692 0.75 MAPK1 (0.39) L3MBTL1ALDH1A1
SCHEMBL5372976 0.75 IDO1 (0.43) MAOBIDO1MAOAFFAR4FFAR1
SCHEMBL5389354 0.75 MAPK1 (0.43) IDO1L3MBTL1HTTPOLBALDH1A1
SCHEMBL5389477 0.74 L3MBTL1 (0.43) IDO1L3MBTL1MAPTALDH1A1
SCHEMBL14350063 0.74 HTR1A (0.40) MAPTHTTALDH1A1KDM4E
SCHEMBL5378284 0.74 TDP1 (0.39) L3MBTL1MAPTALDH1A1
SCHEMBL5378069 0.73 CYP1A2 (0.47) MAOBL3MBTL1MAPTALDH1A1
SCHEMBL5417437 0.73 MEN1 (0.41) MAOAL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070293510-A1 Thiadiazole compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED ( A JAPANESE CORPORATION) (JP) 2007-12-20 US disclosed
US-20070293510-A1 Thiadiazole compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED ( A JAPANESE CORPORATION) (JP) 2007-12-20 US disclosed
US-20070293510-A1 Thiadiazole compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED ( A JAPANESE CORPORATION) (JP) 2007-12-20 US disclosed
US-7273879-B2 Thiadiazole compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-09-25 US disclosed
US-7273879-B2 Thiadiazole compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-09-25 US disclosed
US-7273879-B2 Thiadiazole compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-09-25 US disclosed
US-20050215578-A1 Thiadiazole compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-09-29 US disclosed
EP-1475374-A1 THIADIAZOLE COMPOUNDS AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-10 EP 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 (2 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-20050215578-A1 Thiadiazole compounds and use thereof C5, C3AR1, TH MAOB 641/4885IDO1 890/4885MAOA 1727/4885
US-20070293510-A1 Thiadiazole compounds and use thereof C5, C3AR1, TH MAOB 700/4885IDO1 912/4885MAOA 1789/4885

“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.