SCHEMBL2880181

SCHEMBL2880181

CCC(CS)C(=O)NCCN(C)C

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.59
TSHR P16473 1/20 0.59
DNM1 Q05193 1/20 0.41
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.38
PKM P14618 1/20 0.38
CA1 P00915 3/20 0.37
CA2 P00918 3/20 0.37
CA7 P43166 1/20 0.37
CA14 Q9ULX7 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAPK1 P28482 1/20 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

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
SCHEMBL2875129 0.91 USP2 (0.48) USP2TSHRDNM1HTTSMN1; SMN2
SCHEMBL13850713 0.91 USP2 (0.71) USP2TSHRDNM1HTTSMN1; SMN2
SCHEMBL2877948 0.88 USP2 (0.57) USP2TSHRDNM1HTTSMN1; SMN2
SCHEMBL2876900 0.86 TSHR (0.46) USP2TSHRDNM1HTTSMN1; SMN2
SCHEMBL2880160 0.86 USP2 (0.44) USP2TSHRDNM1HTTSMN1; SMN2
SCHEMBL2876480 0.83 USP2 (0.41) USP2TSHRDNM1HTTSMN1; SMN2
SCHEMBL2875724 0.81 USP2 (0.47) USP2TSHRDNM1HTTSMN1; SMN2
SCHEMBL2868512 0.81 USP2 (0.40) USP2TSHRDNM1HTTSMN1; SMN2
SCHEMBL19116116 0.81 USP2 (0.57) USP2TSHRDNM1HTTSMN1; SMN2
SCHEMBL2868478 0.79 USP2 (0.59) USP2TSHRCYP2C19ALDH1A1CA1

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
EP-1570835-B1 Composition for the permanent deformation of the hair comprising at least one carboxydithiol OREAL (FR) 2010-10-20 EP claimed
EP-1570835-B1 Composition for the permanent deformation of the hair comprising at least one carboxydithiol OREAL (FR) 2010-10-20 EP disclosed