SCHEMBL7145285

SCHEMBL7145285

CCOC(=O)CC(CCCNC(=O)c1csc(NC(=O)NCc2ccccc2)n1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ROCK2 O75116 1/20 0.43
ROCK1 Q13464 1/20 0.43
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
TP53 P04637 1/20 0.42
RAD52 P43351 1/20 0.42
PPID Q08752 1/20 0.41
HIF1A Q16665 1/20 0.41
KDM4E B2RXH2 1/20 0.41
HSP90AA1 P07900 1/20 0.41
ITGB3 P05106 3/20 0.41
ITGAV P06756 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HDAC6 Q9UBN7 1/20 0.40
PARP1 P09874 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL7145905 0.89 RAB9A (0.44) RAB9ANPC1SMN1; SMN2ROCK2ROCK1
SCHEMBL7141230 0.89 ROCK2 (0.48) SMN1; SMN2ROCK2ROCK1RAD52HIF1A
SCHEMBL7141236 0.89 ROCK2 (0.48) SMN1; SMN2ROCK2ROCK1RAD52HIF1A
SCHEMBL7145110 0.86 F2 (0.46) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL7147820 0.85 LMNA (0.48) RAB9ANPC1SMN1; SMN2ROCK2ROCK1
SCHEMBL7141440 0.84 LCK (0.54) RAB9ANPC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL15145661 0.82 PPID (0.60) RAB9ANPC1SMN1; SMN2ROCK2ROCK1
SCHEMBL7136501 0.80 PPID (0.45) RAB9ANPC1SMN1; SMN2ROCK2ROCK1
SCHEMBL7138958 0.79 PPID (0.48) RAB9ANPC1SMN1; SMN2ROCK2ROCK1
SCHEMBL7142027 0.79 PPID (0.48) RAB9ANPC1SMN1; SMN2ROCK2ROCK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
EP-0928790-B1 Thiazole derivatives HOFFMANN LA ROCHE (CH) 2003-03-05 EP 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
EP-0928790-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 RAB9A 1440/4885NPC1 987/4885SMN1; SMN2 3186/4885

“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.