SCHEMBL4984920

SCHEMBL4984920

Cc1cc(C(=O)CBr)c(C)c(C)c1C

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 10/20 0.41
PTPN1 P18031 6/20 0.36
HPGDS O60760 1/20 0.35
GAA P10253 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL15698069 0.81 HSP90AB1 (0.42) GAAMEN1KMT2AALDH1A1
SCHEMBL9532477 0.81 GSK3B (0.32) GSK3BGAAMEN1KMT2AALDH1A1
SCHEMBL22359915 0.78 GSK3B (0.48) GSK3BPTPN1GAAMEN1KMT2A
SCHEMBL9278783 0.78 MAPT (0.38) MEN1KMT2AALDH1A1
SCHEMBL28256316 0.77 LMNA (0.41) GSK3BMEN1KMT2AALDH1A1HPGD
SCHEMBL865601 0.76 MEN1 (0.36) GSK3BMEN1KMT2AALDH1A1HPGD
SCHEMBL7787256 0.75 KMT2A (0.37) GAAMEN1KMT2AALDH1A1
SCHEMBL11364813 0.74 GSK3B (0.43) GSK3BPTPN1
SCHEMBL11956604 0.74 GSK3B (0.54) GSK3BPTPN1MEN1KMT2AALDH1A1
SCHEMBL7528224 0.73 GSK3B (0.39) GSK3BPTPN1HPGDSMEN1KMT2A

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-20080009416-A1 THIAZOLIUM COMPOUNDS AND USES THEREOF MYCOSOL, INC. 2008-01-10 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-20080009416-A1 THIAZOLIUM COMPOUNDS AND USES THEREOF TST, TYR, THOP1 GSK3B 1848/4885PTPN1 834/4885HPGDS 440/4885

“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.