SCHEMBL5387247

SCHEMBL5387247

CSc1nsc(OCc2cncnc2)n1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 4/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 2/20 0.32
TSHR P16473 2/20 0.32
MAPT P10636 2/20 0.30
HSD17B10 Q99714 1/20 0.30
POLB P06746 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL14350063 0.83 HTR1A (0.40) ALDH1A1MEN1KMT2ALMNATSHR
SCHEMBL5398160 0.82 MEN1 (0.39) MAPK1TDP1CYP1A2CYP2C9CYP2C19
SCHEMBL5377736 0.80 LMNA (0.47) MAPK1TDP1CYP1A2CYP2C9CYP2C19
SCHEMBL5388607 0.79 RAB9A (0.52) TDP1CYP1A2L3MBTL1ALDH1A1MEN1
SCHEMBL5417437 0.79 MEN1 (0.41) MAPK1TDP1CYP1A2CYP2C9CYP2C19
SCHEMBL5378069 0.79 CYP1A2 (0.47) MAPK1TDP1CYP1A2CYP2C9CYP2C19
SCHEMBL5378052 0.78 MEN1 (0.41) MAPK1TDP1CYP1A2CYP2C9CYP2C19
SCHEMBL5378771 0.78 TDP1 (0.56) MAPK1TDP1CYP1A2CYP2C9CYP2C19
SCHEMBL5389354 0.78 MAPK1 (0.43) MAPK1TDP1CYP1A2CYP2C9CYP2C19
SCHEMBL5373434 0.78 CYP1A2 (0.43) MAPK1TDP1CYP1A2CYP2C9CYP2C19

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 MAPK1 509/4885TDP1 1173/4885CYP1A2 24/4885
US-20070293510-A1 Thiadiazole compounds and use thereof C5, C3AR1, TH MAPK1 488/4885TDP1 1150/4885CYP1A2 30/4885

“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.