SCHEMBL2880189

SCHEMBL2880189

COC(=O)C(CS)CCCS

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
FOLH1 Q04609 8/20 0.49
CPB2 Q96IY4 4/20 0.47
ZDHHC7 Q9NXF8 1/20 0.36
PDF Q9HBH1 1/20 0.35
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CPN1 P15169 1/20 0.34
KMT2A Q03164 1/20 0.34
BIRC2 Q13490 1/20 0.33
ENPEP Q07075 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
SCHEMBL2871469 0.94 CPB2 (0.50) CA1CA2FOLH1CPB2ZDHHC7
SCHEMBL2871738 0.87 CA1 (0.45) CA1CA2FOLH1CPB2ZDHHC7
SCHEMBL3238313 0.86 CA2 (0.71) CA1CA2FOLH1CPB2ZDHHC7
SCHEMBL2879991 0.82
SCHEMBL2875679 0.82 CPB2 (0.69) CA1CA2FOLH1CPB2HSD17B10
SCHEMBL15166984 0.78 FOLH1 (0.41) CA1CA2FOLH1ZDHHC7TSHR
SCHEMBL2877742 0.78 CA1 (0.48) CA1CA2FOLH1CPB2ZDHHC7
SCHEMBL9814818 0.78 SLC1A1 (0.47) CA1CA2FOLH1CPB2TSHR
SCHEMBL10962217 0.77 FOLH1 (0.40) CA1CA2FOLH1ZDHHC7TSHR
SCHEMBL2880166 0.76 CPB2 (0.72) CA1CA2FOLH1CPB2HSD17B10

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
EP-1570835-B1 Composition for the permanent deformation of the hair comprising at least one carboxydithiol OREAL (FR) 2010-10-20 EP claimed
US-20050208007-A1 Composition to permanently reshape the hair containing at least one carboxydithiol L'OREAL S.A. (FR) 2005-09-22 US claimed
US-20050208007-A1 Composition to permanently reshape the hair containing at least one carboxydithiol L'OREAL S.A. (FR) 2005-09-22 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-20050208007-A1 Composition to permanently reshape the hair containing at least one carboxydithiol CTH, BHMT2, CRAT CA1 913/4885CA2 409/4885FOLH1 68/4885

“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.