SCHEMBL6133465

SCHEMBL6133465

CC(=O)NCCNC(=O)c1nc(-c2ccccc2)c(-c2ccc(=O)n(C(C)C)n2)s1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.39
TP53 P04637 1/20 0.39
DGAT1 O75907 1/20 0.38
KDM4E B2RXH2 3/20 0.37
RXFP1 Q9HBX9 1/20 0.37
ADORA2A P29274 3/20 0.36
ADORA1 P30542 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 3/20 0.35
MAPT P10636 2/20 0.35
POLB P06746 2/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
XIAP P98170 1/20 0.35
KDM5B Q9UGL1 1/20 0.35
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34

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
SCHEMBL6134311 0.91 HPGD (0.41) HSD17B10TP53DGAT1KDM4ERXFP1
SCHEMBL6135410 0.90 RAB9A (0.44) DGAT1KDM4EMEN1KMT2AALDH1A1
SCHEMBL6133793 0.90 HSD17B10 (0.46) HSD17B10TP53DGAT1KDM4EMEN1
SCHEMBL6134990 0.90 MAPT (0.42) HSD17B10DGAT1MEN1KMT2AALDH1A1
SCHEMBL6133811 0.89 NPC1 (0.40) HSD17B10TP53DGAT1KDM4EADORA2A
SCHEMBL6924703 0.89 CAMK2D (0.42) HSD17B10TP53KDM4EKMT2APOLB
SCHEMBL6133161 0.87 L3MBTL1 (0.47) HSD17B10MEN1KMT2AALDH1A1POLB
SCHEMBL6134295 0.86 TP53 (0.37) HSD17B10TP53KDM4EADORA2AADORA1
SCHEMBL6134642 0.86 TP53 (0.41) HSD17B10TP53KDM4EADORA2AADORA1
SCHEMBL6133519 0.86 CYP3A4 (0.43) KDM4EADORA2AADORA1MEN1KMT2A

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 HSD17B10 391/4885TP53 4124/4885DGAT1 1933/4885

“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.