SCHEMBL2492793

SCHEMBL2492793

CC(C)[C@@H](NC(=O)OCc1ccccc1)[C@H](CC(=O)O)O[Si](C(C)C)(C(C)C)C(C)C

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.49
ELANE P08246 2/20 0.46
CASP3 P42574 1/20 0.46
CASP1 P29466 6/20 0.46
CTSK P43235 4/20 0.45
CTSL P07711 2/20 0.45
CTSB P07858 2/20 0.45
CTSS P25774 2/20 0.45
PRTN3 P24158 1/20 0.44
CTRB1 P17538 2/20 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
SCHEMBL2501207 0.91 ATM (0.47) ATMELANECTSKCTSLCTSB
SCHEMBL3276084 0.85 ATM (0.49) ATMELANECASP3CASP1CTSK
SCHEMBL14493005 0.81 ATM (0.39) ATMELANECASP1CTSKCTSL
SCHEMBL12906609 0.81 ATM (0.61) ATMELANECTSKCTSLCTSB
SCHEMBL3338883 0.80 ATM (0.52) ATMELANECASP3CASP1CTSK
SCHEMBL3274393 0.80 ATM (0.52) ATMELANECASP3CASP1CTSK
SCHEMBL3339842 0.80 ATM (0.52) ATMELANECASP3CASP1CTSK
SCHEMBL19859590 0.76 ATM (0.56) ATMELANECASP3CASP1CTSK
SCHEMBL9749127 0.76 ATM (0.56) ATMELANECASP3CASP1CTSK
SCHEMBL3202235 0.76 ATM (0.56) ATMELANECASP3CASP1CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8030279-B2 Tamandarin analogs and fragments thereof and methods of making and using THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2011-10-04 US disclosed
US-20070149446-A1 Tamandarin analogs and fragments thereof and methods of making and using THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA CENTER FOR TECHNOLOGY TRANSFER (US) 2007-06-28 US 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-20070149446-A1 Tamandarin analogs and fragments thereof and methods of making and using FOXM1, F3, RB1 ATM 1572/4885ELANE 1539/4885CASP3 331/4885

“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.