SCHEMBL5387403

SCHEMBL5387403

CSc1nsc(OCCc2ccccc2)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
TSHR P16473 1/20 0.45
PPARG P37231 5/20 0.40
ALOX5 P09917 4/20 0.40
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PTGES O14684 3/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
ALOX15 P16050 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PSEN1 P49768 1/20 0.36
HSP90AA1 P07900 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
SCHEMBL5383484 0.93 LMNA (0.44) ALDH1A1LMNATSHRPPARGALOX5
SCHEMBL5377736 0.85 LMNA (0.47) ALDH1A1LMNATSHRPPARGALOX5
SCHEMBL14350064 0.82 SMN1; SMN2 (0.45) ALDH1A1LMNARAB9ANPC1SMN1; SMN2
SCHEMBL5378771 0.73 TDP1 (0.56) ALDH1A1LMNAMAPK1TDP1MEN1
SCHEMBL14350063 0.73 HTR1A (0.40) ALDH1A1LMNATSHRMEN1KMT2A
SCHEMBL5381751 0.72 SYK (0.46) ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL5378069 0.72 CYP1A2 (0.47) ALDH1A1LMNATSHRMAPK1TDP1
SCHEMBL5417437 0.72 MEN1 (0.41) ALDH1A1LMNATSHRMAPK1TDP1
SCHEMBL14207826 0.71 ALDH1A1 (0.51) ALDH1A1LMNATSHRPPARGMAPK1
SCHEMBL5375933 0.71 RAB9A (0.38) ALDH1A1LMNATSHRMAPK1TDP1

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 ALDH1A1 654/4885LMNA 3208/4885TSHR 332/4885
US-20070293510-A1 Thiadiazole compounds and use thereof C5, C3AR1, TH ALDH1A1 683/4885LMNA 3325/4885TSHR 378/4885

“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.