SCHEMBL4875737

SCHEMBL4875737

CC(=O)Nc1nc(CCc2ccc(NC(N(C(=O)O)C(C)(C)C)N(C(=O)O)C(C)(C)C)cc2)c(C(=O)NCCNC(=O)Cc2ccccc2)s1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.40
AOC3 Q16853 3/20 0.39
MAPT P10636 2/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36
CSNK1D P48730 3/20 0.35
MAPK8 P45983 1/20 0.35
MAPK10 P53779 1/20 0.35
GLS O94925 3/20 0.35
RXFP1 Q9HBX9 1/20 0.35
RORC P51449 2/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GAA P10253 1/20 0.33
HPGD P15428 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
SCHEMBL4986159 0.91 AOC3 (0.37) AOC3RXFP1
SCHEMBL4864961 0.90 SCD (0.42) SCDAOC3MAPTPOLBRAB9A
SCHEMBL4990573 0.89 SCD (0.39) SCDAOC3MAPTPOLBRAB9A
SCHEMBL4877574 0.87 AOC3 (0.38) AOC3MAPTPOLBRAB9ARXFP1
SCHEMBL4985427 0.87 AOC3 (0.41) AOC3MAPTPOLBRAB9ARXFP1
SCHEMBL4875654 0.87 AOC3 (0.37) AOC3
SCHEMBL4982245 0.87 AOC3 (0.36) AOC3MAPTPOLBRAB9A
SCHEMBL4987276 0.86 AOC3 (0.37) AOC3
SCHEMBL4875746 0.86 GHSR (0.36) AOC3HPGD
SCHEMBL4871385 0.85 AOC3 (0.41) AOC3RXFP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7442715-B2 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2008-10-28 US disclosed
US-20060276521-A1 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2006-12-07 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-20060276521-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 SCD 2681/4885AOC3 782/4885MAPT 320/4885

“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.