SCHEMBL4374693

SCHEMBL4374693

CCOC(=O)Cc1cc(OC(=O)C(N)CCSC)cc2c1CCCC2

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 3/20 0.38
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MARS1 P56192 8/20 0.35
PPID Q08752 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
METAP2 P50579 1/20 0.30
METAP1 P53582 1/20 0.30
LMNA P02545 1/20 0.30

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
Racemethionine SCHEMBL4374692 0.83 NLRP3 (0.36) NLRP3MARS1PPIDMEN1KMT2A
SCHEMBL2998422 0.77 NLRP3 (0.46) NLRP3KDM4EALDH1A1HPGDGLA
SCHEMBL2998076 0.72 NLRP3 (0.48) NLRP3KDM4EALDH1A1HPGDGAA
SCHEMBL3000425 0.71 NLRP3 (0.43) NLRP3KDM4EALDH1A1MAPTHSD17B10
SCHEMBL12229225 0.67 LMNA (0.43) ALDH1A1GAAMARS1MEN1KMT2A
SCHEMBL12229268 0.67 LMNA (0.43) ALDH1A1GAAMARS1MEN1KMT2A
SCHEMBL13038941 0.66 NLRP3 (0.42) NLRP3KDM4EALDH1A1GAAMAPT
SCHEMBL19283982 0.65 LMNA (0.49) GAAMAPTHSD17B10MARS1LMNA
SCHEMBL5443843 0.65 METAP2 (0.53) MARS1PPIDMETAP2METAP1
SCHEMBL113611 0.65 METAP2 (0.53) MARS1PPIDMETAP2METAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2070921-A1 Indolylmaleimide derivatives as protein kinase c inhibitors Novartis Ag (CH) 2009-06-17 EP disclosed
US-20070191401-A1 Transplant rejection, autoimmune disease, autoimmune disease ALBERT RAINER 2007-08-16 US disclosed
EP-1337527-A1 INDOLYLMALEIMIDE DERIVATIVES AS PROTEIN KINASE C INHIBITORS Novartis AG (CH) 2003-08-27 EP disclosed
WO-2002038561-A1 INDOLYLMALEIMIDE DERIVATIVES AS PROTEIN KINASE C INHIBITORS NOVARTIS AG (CH) 2002-05-16 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-20070191401-A1 Transplant rejection, autoimmune disease, autoimmune disease NFATC1, HLA-DRB1, INMT NLRP3 210/4885KDM4E 832/4885ALDH1A1 1866/4885

“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.