SCHEMBL10037239

SCHEMBL10037239

CC(C)(C)CC(=O)Nc1ccsc1C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ABCC1 P33527 1/20 0.57
PTPN2 P17706 1/20 0.57
PTPN1 P18031 1/20 0.57
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
RAB9A P51151 4/20 0.52
NPC1 O15118 3/20 0.52
MAPK8 P45983 5/20 0.50
MAPK10 P53779 5/20 0.50
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MAPK9 P45984 3/20 0.48
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45

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
SCHEMBL14609709 0.80 PTPN2 (0.64) ABCC1PTPN2PTPN1MEN1KMT2A
SCHEMBL5103381 0.79 ABCC1 (0.63) ABCC1PTPN2PTPN1MEN1KMT2A
SCHEMBL28804997 0.79 PTPN2 (0.62) ABCC1PTPN2PTPN1MEN1KMT2A
SCHEMBL7821857 0.79 PTPN2 (0.62) ABCC1PTPN2PTPN1MEN1KMT2A
SCHEMBL2255525 0.78 ABCC1 (0.57) ABCC1PTPN2PTPN1MEN1KMT2A
SCHEMBL4958864 0.77 ABCC1 (0.60) ABCC1PTPN2PTPN1MEN1KMT2A
SCHEMBL1704250 0.76 PTPN2 (0.68) ABCC1PTPN2PTPN1MEN1KMT2A
SCHEMBL23931980 0.76 PTPN2 (0.72) ABCC1PTPN2PTPN1MEN1KMT2A
SCHEMBL429230 0.75 PTPN2 (0.57) ABCC1PTPN2PTPN1MEN1KMT2A
SCHEMBL14231553 0.75 ABCC1 (0.57) ABCC1PTPN2PTPN1MEN1KMT2A

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-20120077711-A1 Novel Ligands and Libraries of Ligands SUNESIS PHARMACEUTICALS, INC. (US) 2012-03-29 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-20120077711-A1 Novel Ligands and Libraries of Ligands LSS, ABCG2, SELL ABCC1 852/4885PTPN2 2234/4885PTPN1 2211/4885

“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.