SCHEMBL6133506

SCHEMBL6133506

CC(C)n1nc(-c2sc(C(=O)NCCN3CCOCC3)nc2-c2ccccc2)ccc1=O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM5B Q9UGL1 8/20 0.49
KMT2A Q03164 3/20 0.47
LMNA P02545 1/20 0.47
HPGD P15428 2/20 0.47
CD274 Q9NZQ7 1/20 0.47
ADORA2A P29274 1/20 0.46
ADORA1 P30542 1/20 0.46
MEN1 O00255 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MMP12 P39900 1/20 0.44
HPGDS O60760 2/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL6133773 0.85 PTGS2 (0.48) LMNAADORA2AADORA1NPC1ALDH1A1
SCHEMBL6134311 0.85 HPGD (0.41) KMT2AHPGDADORA2AMEN1SMN1; SMN2
Hydrochloric Acid SCHEMBL6133533 0.85 PTGS2 (0.48) LMNAADORA2AADORA1NPC1ALDH1A1
SCHEMBL6133465 0.84 HSD17B10 (0.39) KDM5BKMT2AADORA2AADORA1MEN1
SCHEMBL6133850 0.83 HPGD (0.45) KMT2ALMNAHPGDMEN1SMN1; SMN2
SCHEMBL6133793 0.83 HSD17B10 (0.46) KMT2AMEN1SMN1; SMN2KDM4E
SCHEMBL6134990 0.83 MAPT (0.42) KMT2ALMNAMEN1NPC1ALDH1A1
SCHEMBL6135410 0.83 RAB9A (0.44) KMT2ALMNAHPGDMEN1SMN1; SMN2
Hydrochloric Acid SCHEMBL6133484 0.83 ALDH1A1 (0.49) KMT2ALMNAADORA2AADORA1KDM4E
SCHEMBL6133811 0.83 NPC1 (0.40) HPGDADORA2AADORA1SMN1; SMN2KDM4E

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 KDM5B 3722/4885KMT2A 2724/4885LMNA 4780/4885

“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.