SCHEMBL6134033

SCHEMBL6134033

CC(C)n1nc(-c2sc(N)nc2-c2ccc(F)cc2)ccc1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 3/20 0.48
ADORA2A P29274 3/20 0.44
ADORA1 P30542 3/20 0.44
MAPT P10636 2/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 1/20 0.41
XBP1 P17861 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
FBP1 P09467 1/20 0.40
RET P07949 2/20 0.39
MYC P01106 1/20 0.38
WDR5 P61964 1/20 0.38
KCNH2 Q12809 1/20 0.38
ALDH1A1 P00352 2/20 0.37
CYP1A2 P05177 2/20 0.37
CYP2D6 P10635 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP3A4 P08684 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
SCHEMBL6134226 0.88 ALDH1A1 (0.51) TGFBR1MAPTKDM4ELMNAXBP1
Bromide SCHEMBL6133333 0.87 ALDH1A1 (0.50) TGFBR1MAPTKDM4ELMNAXBP1
SCHEMBL6133824 0.87 MAPT (0.39) TGFBR1ADORA2AADORA1MAPTKDM4E
SCHEMBL28638256 0.86 TGFBR1 (0.43) TGFBR1ADORA2AADORA1MAPTKDM4E
SCHEMBL6133930 0.84 RET (0.42) TGFBR1ADORA2AADORA1KDM4ERET
SCHEMBL6134790 0.82 TGFBR1 (0.41) TGFBR1ADORA2AADORA1KDM4ESMN1; SMN2
SCHEMBL6133426 0.82 TGFBR1 (0.45) TGFBR1ADORA2AADORA1MAPTKDM4E
SCHEMBL6135077 0.81 ADORA2A (0.36) TGFBR1ADORA2AADORA1RETKCNH2
SCHEMBL6133441 0.81 ALDH1A1 (0.47) ADORA2AADORA1MAPTKDM4ELMNA
SCHEMBL6133040 0.81 GABRA5 (0.40) TGFBR1ADORA2AADORA1KDM4ERET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109293652-B Substituted thiazole derivative and application thereof 四川科伦博泰生物医药股份有限公司 2021-10-22 CN disclosed
US-20050004134-A1 Thiazole derivative and pharmaceutical use thereof ASTELLAS PHARMA INC. (JP) 2005-01-06 US disclosed
EP-1441732-A2 THIAZOLE DERIVATIVE AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-04 EP disclosed
WO-2003039451-A2 THIAZOLE PYRIDAZINONES AS ADENOSINE ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-05-15 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-20050004134-A1 Thiazole derivative and pharmaceutical use thereof MC2R, CYP2C9, OXTR TGFBR1 966/4885ADORA2A 635/4885ADORA1 243/4885

“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.