SCHEMBL2880160

SCHEMBL2880160

CN(C)CCNC(=O)C(CS)CCS

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
PKM P14618 1/20 0.38
DNM1 Q05193 1/20 0.38
MAPK1 P28482 1/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA12 O43570 1/20 0.36
CA9 Q16790 1/20 0.36
MME P08473 1/20 0.36
ACE P12821 1/20 0.36
RECQL P46063 1/20 0.35

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
SCHEMBL2875724 0.93 USP2 (0.47) USP2TSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL2875129 0.91 USP2 (0.48) USP2TSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL2876900 0.90 TSHR (0.46) USP2TSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL2876480 0.90 USP2 (0.41) USP2TSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL2868512 0.88 USP2 (0.40) USP2TSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL2877948 0.88 USP2 (0.57) USP2TSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL2880181 0.86 USP2 (0.59) USP2TSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL2876943 0.79 ALDH1A1 (0.48) USP2TSHRALDH1A1KDM4EMAPK1
SCHEMBL13850713 0.79 USP2 (0.71) USP2TSHRHTTSMN1; SMN2ALDH1A1
SCHEMBL21232896 0.78 TSHR (0.52) USP2TSHRHTTSMN1; SMN2ALDH1A1

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 5 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
EP-1570835-A1 Composition for the permanent deformatioh of the hair comprising at least one carboxydithiol L'OREAL (FR) 2005-09-07 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 disclosed
EP-1570835-A1 Composition for the permanent deformatioh of the hair comprising at least one carboxydithiol L'OREAL (FR) 2005-09-07 EP 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 USP2 1040/4885TSHR 2850/4885HTT 443/4885

“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.