SCHEMBL7143224

SCHEMBL7143224

CC(C)(C)OC(=O)NCc1nc(C(=O)NCC(=O)NC(CC(=O)O)c2ccccc2)cs1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 4/20 0.46
HDAC1 Q13547 4/20 0.46
HDAC6 Q9UBN7 4/20 0.46
ITGB3 P05106 2/20 0.40
ITGA2B P08514 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
PTPRB P23467 1/20 0.39
ITGAV P06756 1/20 0.39
SLC6A9 P48067 1/20 0.38
MMP3 P08254 1/20 0.38
MMP9 P14780 1/20 0.38
MMP8 P22894 1/20 0.38
MMP12 P39900 1/20 0.38
MMP13 P45452 1/20 0.38
GPR139 Q6DWJ6 1/20 0.38
LMNA P02545 1/20 0.37
CTSA P10619 1/20 0.37
ABCB1 P08183 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36

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
SCHEMBL7136785 0.83 ITGB3 (0.50) HDAC1HDAC6ITGB3ITGA2BSMN1; SMN2
Hydrochloric Acid SCHEMBL7136531 0.83 ITGB3 (0.49) HDAC1HDAC6ITGB3ITGA2BSMN1; SMN2
SCHEMBL7144735 0.82 ITGB3 (0.47) HDAC1HDAC6ITGB3ITGA2BSMN1; SMN2
SCHEMBL7143222 0.81 ITGB3 (0.41) HDAC1HDAC6ITGB3ITGA2BSMN1; SMN2
SCHEMBL18989461 0.81 SMN1; SMN2 (0.48) ITGB3ITGA2BSMN1; SMN2ITGAVSLC6A9
SCHEMBL18989460 0.81 SMN1; SMN2 (0.48) ITGB3ITGA2BSMN1; SMN2ITGAVSLC6A9
Hydrochloric Acid SCHEMBL7140436 0.81 ITGB3 (0.46) HDAC1HDAC6ITGB3ITGA2BSMN1; SMN2
SCHEMBL15152459 0.78 SUCNR1 (0.39) HDAC3HDAC1HDAC6ITGB3ITGA2B
SCHEMBL7144797 0.78 ITGB3 (0.48) HDAC1HDAC6ITGB3ITGA2BSMN1; SMN2
SCHEMBL7144784 0.78 ITGB3 (0.48) HDAC1HDAC6ITGB3ITGA2BSMN1; SMN2

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-20020010316-A1 Thiazole derivatives ALIG LEO (CH) 2002-01-24 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 HDAC3 1672/4885HDAC1 2069/4885HDAC6 1924/4885

“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.