SCHEMBL6134295

SCHEMBL6134295

CC(C)n1nc(-c2sc(C(=O)NCC(N)=O)nc2-c2ccccc2)ccc1=O

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.37
XIAP P98170 3/20 0.37
KDM4E B2RXH2 1/20 0.35
PTGS2 P35354 4/20 0.35
ALDH1A1 P00352 3/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
POLB P06746 1/20 0.35
RET P07949 1/20 0.35
ADORA2A P29274 2/20 0.34
ADORA1 P30542 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL6133811 0.89 NPC1 (0.40) TP53XIAPKDM4EALDH1A1HSD17B10
SCHEMBL6133161 0.87 L3MBTL1 (0.47) ALDH1A1HSD17B10POLB
SCHEMBL6134311 0.87 HPGD (0.41) TP53KDM4EALDH1A1HSD17B10MAPT
SCHEMBL6133425 0.87 RET (0.41) TP53XIAPKDM4EALDH1A1MAPT
SCHEMBL6133465 0.86 HSD17B10 (0.39) TP53XIAPKDM4EALDH1A1HSD17B10
SCHEMBL6134642 0.86 TP53 (0.41) TP53XIAPKDM4EALDH1A1HSD17B10
SCHEMBL6135410 0.86 RAB9A (0.44) KDM4EALDH1A1POLBCYP1A2CYP2C9
SCHEMBL6133793 0.86 HSD17B10 (0.46) TP53KDM4EHSD17B10HTT
SCHEMBL6134990 0.86 MAPT (0.42) ALDH1A1HSD17B10MAPTPOLBCYP1A2
SCHEMBL6133813 0.85 ALOX15 (0.46) TP53XIAPKDM4EPTGS2ALDH1A1

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-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 TP53 4124/4885XIAP 4881/4885KDM4E 3814/4885

“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.