SCHEMBL7143502

SCHEMBL7143502

CCOC(=O)CC(NC(=O)CCN)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 3/20 0.48
TP53 P04637 2/20 0.48
LMNA P02545 2/20 0.48
HTT P42858 1/20 0.47
ALDH1A1 P00352 3/20 0.46
POLB P06746 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
GAA P10253 1/20 0.45
ITGB3 P05106 1/20 0.44
ITGA2B P08514 1/20 0.44
RXFP1 Q9HBX9 1/20 0.43
MDM4 O15151 1/20 0.43
MDM2 Q00987 1/20 0.43
F2 P00734 1/20 0.43

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
Hexane SCHEMBL7142268 0.95 SMN1; SMN2 (0.47) MAPTSMN1; SMN2TP53LMNAHTT
SCHEMBL3835077 0.90 LMNA (0.49) MAPTSMN1; SMN2TP53LMNAHTT
Hydrochloric Acid SCHEMBL7137163 0.89 LMNA (0.48) MAPTSMN1; SMN2TP53LMNAHTT
SCHEMBL16268748 0.87 LMNA (0.51) MAPTSMN1; SMN2TP53LMNAHTT
SCHEMBL9222366 0.85 MMP9 (0.46) MAPTSMN1; SMN2HTTALDH1A1ITGB3
SCHEMBL9222177 0.85 MMP9 (0.46) MAPTSMN1; SMN2HTTALDH1A1ITGB3
SCHEMBL4246122 0.85 LMNA (0.49) MAPTSMN1; SMN2TP53LMNAHTT
SCHEMBL4242162 0.85 LMNA (0.49) MAPTSMN1; SMN2TP53LMNAHTT
SCHEMBL28402265 0.83 LMNA (0.46) MAPTSMN1; SMN2TP53LMNAHTT
SCHEMBL1144389 0.83 KMT2A (0.52) MAPTSMN1; SMN2LMNAHTTALDH1A1

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-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 MAPT 86/4885SMN1; SMN2 3186/4885TP53 525/4885

“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.