SCHEMBL6133645

SCHEMBL6133645

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

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
XIAP P98170 1/20 0.35
P2RY6 Q15077 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
NPC1 O15118 1/20 0.34
HPGD P15428 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
CASP3 P42574 1/20 0.33
CDK9 P50750 1/20 0.33
CASP7 P55210 1/20 0.33
RET P07949 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
SCHEMBL6133425 0.87 RET (0.41) TP53POLBKMT2AXIAPP2RY6
SCHEMBL6134642 0.86 TP53 (0.41) TP53POLBXIAPP2RY6NPC1
SCHEMBL6133813 0.85 ALOX15 (0.46) TP53POLBKMT2AMEN1XIAP
SCHEMBL6133894 0.84 TP53 (0.36) TP53POLBXIAPP2RY6KDM4E
SCHEMBL6924703 0.83 CAMK2D (0.42) TP53POLBKMT2AHPGDKDM4E
SCHEMBL6133811 0.83 NPC1 (0.40) TP53POLBXIAPSMN1; SMN2NPC1
SCHEMBL6133228 0.83 XIAP (0.48) TP53KMT2AMEN1XIAPALDH1A1
SCHEMBL6133914 0.82 HPGD (0.42) TP53POLBKMT2AMEN1SMN1; SMN2
SCHEMBL6133924 0.82 PTGS2 (0.44) KMT2AMEN1SMN1; SMN2NPC1HPGD
SCHEMBL6134884 0.82 ALDH1A1 (0.40) TP53POLBKMT2AMEN1XIAP

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 1 patent. 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

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 4124/4885POLB 3447/4885KMT2A 2724/4885

“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.