SCHEMBL7147053

SCHEMBL7147053

CCOC(=O)c1sc(NC(=O)NC)nc1C

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.74
HPGD P15428 7/20 0.74
NPC1 O15118 9/20 0.67
SMN1; SMN2 Q16637 9/20 0.65
RAB9A P51151 7/20 0.65
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
HTT P42858 2/20 0.65
GAA P10253 2/20 0.65
MAPT P10636 2/20 0.65
NFKB1 P19838 1/20 0.65
NFKB2 Q00653 1/20 0.65
RELA Q04206 1/20 0.65
TSHR P16473 2/20 0.64
KDM4E B2RXH2 3/20 0.62
LMNA P02545 2/20 0.62
NPSR1 Q6W5P4 2/20 0.62
RXFP1 Q9HBX9 1/20 0.60
TP53 P04637 1/20 0.58
HSP90AA1 P07900 1/20 0.58

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
SCHEMBL244627 0.87 ALDH1A1 (0.72) ALDH1A1HPGDNPC1SMN1; SMN2RAB9A
SCHEMBL8556695 0.84 L3MBTL1 (0.73) ALDH1A1HPGDNPC1SMN1; SMN2RAB9A
SCHEMBL8555317 0.84 ALDH1A1 (0.76) ALDH1A1HPGDNPC1SMN1; SMN2RAB9A
SCHEMBL27361420 0.82 ALDH1A1 (0.74) ALDH1A1HPGDNPC1SMN1; SMN2RAB9A
SCHEMBL4920930 0.81 SMN1; SMN2 (0.78) ALDH1A1HPGDNPC1SMN1; SMN2RAB9A
SCHEMBL2208204 0.81 ALDH1A1 (0.72) ALDH1A1HPGDNPC1SMN1; SMN2RAB9A
SCHEMBL27224566 0.81 ALDH1A1 (0.76) ALDH1A1HPGDNPC1SMN1; SMN2MEN1
SCHEMBL28340135 0.81 ALDH1A1 (0.76) ALDH1A1HPGDNPC1SMN1; SMN2RAB9A
SCHEMBL7939133 0.81 ALDH1A1 (0.72) ALDH1A1HPGDNPC1SMN1; SMN2MEN1
SCHEMBL4922277 0.80 SMN1; SMN2 (0.80) ALDH1A1HPGDNPC1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0928790-B1 Thiazole derivatives HOFFMANN LA ROCHE (CH) 2003-03-05 EP disclosed
EP-0928793-B1 Thiazole derivatives HOFFMANN LA ROCHE (CH) 2002-05-15 EP disclosed
CN-1080720-C Thiazole derivatives HOFFMANN LA ROCHE (CH) 2002-03-13 CN disclosed
US-6344562-B1 ANTITUMOR AGENTS HOFFMANN-LA ROCHE INC. 2002-02-05 US disclosed
US-20020010316-A1 Thiazole derivatives ALIG LEO (CH) 2002-01-24 US disclosed
US-6320054-B1 INHIBIT BINDING OF ADHESIVE PROTEINS TO THE SURFACE OF DIFFERENT TYPES F CELL AND ACCORDINGLY INFLUENCE CELL-CELL AND CELL-MATRIX INTERACTIONS. HOFFMAN-LA ROCHE INC. 2001-11-20 US disclosed
US-6100282-A Thiazole derivatives HOFFMAN-LA ROCHE INC. (US) 2000-08-08 US disclosed
US-6001855-A REACTING A THIAZOLE DERIVATIVE AND A CYCLIC AMINE DERIVATIVE; INHIBITS BINDING OF ADHESIVE PROTEINS TO THE SURFACE OF DIFFERENT TYPES OF CELL AND ACCORDINGLY INFLUENCE CELL-CELL AND CELL-MATRIX INTERACTIONS HOFFMAN-LA ROCHE INC. (US) 1999-12-14 US disclosed
CN-1224718-A Thiazole derivatives HOFFMANN LA ROCHE (CH) 1999-08-04 CN disclosed
EP-0928790-A1 Thiazole derivatives F. HOFFMANN-LA ROCHE AG (CH) 1999-07-14 EP disclosed
EP-0928793-A1 Thiazole derivatives F. HOFFMANN-LA ROCHE AG (CH) 1999-07-14 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-20020010316-A1 Thiazole derivatives VCAM1, SOST, TGFB1 ALDH1A1 1400/4885HPGD 3734/4885NPC1 987/4885

“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.