SCHEMBL5348579

SCHEMBL5348579

CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)N[C@H](CCC1CCCCC1)C(=S)NCc1ccc(Oc2ccccc2)nc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 1/20 0.52
HSD17B10 Q99714 1/20 0.40
ATM Q13315 1/20 0.39
KMT2A Q03164 4/20 0.37
MEN1 O00255 2/20 0.37
ACACB O00763 2/20 0.37
GRN P28799 2/20 0.36
SORT1 Q99523 2/20 0.36
ACKR3 P25106 1/20 0.34
MAPK14 Q16539 3/20 0.34
GAA P10253 1/20 0.34
MCL1 Q07820 1/20 0.34

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
SCHEMBL4841915 0.91 CACNA1B (0.59) CACNA1BHSD17B10ATMKMT2AMEN1
SCHEMBL5756038 0.90 CACNA1B (0.46) CACNA1BHSD17B10ATMKMT2AMEN1
SCHEMBL5348575 0.87 CACNA1B (0.69) CACNA1BHSD17B10ATMKMT2AMEN1
SCHEMBL5361820 0.86 CACNA1B (0.51) CACNA1BHSD17B10ATMMCL1
SCHEMBL5350467 0.84 CACNA1B (0.49) CACNA1BATMKMT2AMEN1
SCHEMBL5345730 0.84 CACNA1B (0.49) CACNA1BATMKMT2AMEN1
SCHEMBL5349400 0.84 CACNA1B (0.49) CACNA1BATMKMT2AMEN1
SCHEMBL5345749 0.84 CACNA1B (0.49) CACNA1BATMKMT2AMEN1
SCHEMBL5361323 0.84 CACNA1B (0.61) CACNA1BMAPK14
SCHEMBL5112745 0.84 CACNA1B (0.47) CACNA1BHSD17B10ATMKMT2AMEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0997147-B1 AMINO ACID DERIVATIVES ONO PHARMACEUTICAL CO (JP) 2006-03-15 EP claimed
EP-0997147-A1 AMINO ACID DERIVATIVES Ono Pharmaceutical Co., Ltd. (JP) 2000-05-03 EP claimed
US-7166590-B2 Amino acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 2007-01-23 US disclosed
EP-0997147-B1 AMINO ACID DERIVATIVES ONO PHARMACEUTICAL CO (JP) 2006-03-15 EP disclosed
US-20030013725-A1 Amino acid derivatives ONO PHARMACEUTICAL CO., LTD. 2003-01-16 US disclosed
EP-0997147-A1 AMINO ACID DERIVATIVES Ono Pharmaceutical Co., Ltd. (JP) 2000-05-03 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-20030013725-A1 Amino acid derivatives CACNA1B, SCN1A, SCN2A CACNA1B 1/4885HSD17B10 1544/4885ATM 3517/4885

“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.