SCHEMBL1596926

SCHEMBL1596926

COC(=O)CNC(=S)NC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
LMNA P02545 1/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
EPHX1 P07099 2/20 0.47
TET2 Q6N021 1/20 0.47
RECQL P46063 1/20 0.45
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
TSHR P16473 2/20 0.38
HSD17B10 Q99714 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
GAA P10253 1/20 0.37
EPHX2 P34913 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CA12 O43570 1/20 0.36
CA2 P00918 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CYP1A2 P05177 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
SCHEMBL11284075 0.77 TET2 (0.48) ALDH1A1LMNAMEN1KMT2ATET2
SCHEMBL9457498 0.73
SCHEMBL27729676 0.71
SCHEMBL27687085 0.71
SCHEMBL8248295 0.71 RECQL (0.45) LMNAKMT2ATET2RECQLNPC1
SCHEMBL11504339 0.70 ALDH1A1 (0.60) ALDH1A1MEN1KMT2AEPHX1RECQL
SCHEMBL757885 0.70 TET2 (0.50) ALDH1A1LMNATET2RECQLTSHR
SCHEMBL12694105 0.70 TET2 (0.61) ALDH1A1LMNAMEN1KMT2ATET2
SCHEMBL14489950 0.69 MEN1 (0.57) ALDH1A1LMNAMEN1KMT2AEPHX1
SCHEMBL12057423 0.69 GAA (0.46) ALDH1A1LMNAMEN1KMT2ATET2

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
US-7919630-B2 Synthesis of imidazole 2-thiones via thiohydantoins ALLERGAN, INC. (US) 2011-04-05 US disclosed
US-20070203344-A1 SYNTHESIS OF IMIDAZOLE 2-THIONES VIA THIOHYDANTOINS ALLERGAN, INC. 2007-08-30 US disclosed
WO-2007041048-A2 SYNTHESIS OF IMIDAZOLE-2-THIONES VIA THIOHYDANTOINS ALLERGAN, INC. (US) 2007-04-12 WO 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-20070203344-A1 SYNTHESIS OF IMIDAZOLE 2-THIONES VIA THIOHYDANTOINS TPMT, NISCH, IMPDH2 ALDH1A1 784/4885LMNA 4607/4885MEN1 326/4885

“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.