SCHEMBL13626884

SCHEMBL13626884

CC(C)(C)OC(=O)N[C@H](CCO[Si](C)(C)C(C)(C)C)Cc1ccc(N)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.46
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
APP P05067 4/20 0.39
CTSS P25774 6/20 0.38
CTSK P43235 5/20 0.38
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
CYP3A4 P08684 3/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
AGTR1 P30556 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL2617246 0.89 CTSS (0.49) ATMITGB3ITGA2BAPPCTSS
SCHEMBL2617264 0.89 ATM (0.47) ATMITGB3ITGA2BAPPCTSS
SCHEMBL2617257 0.85 ATM (0.43) ATMITGB3ITGA2BAPPCTSS
SCHEMBL2617245 0.83 ATM (0.43) ATMITGB3ITGA2BAPPCTSS
SCHEMBL19257608 0.82 ATM (0.52) ATMITGB3ITGA2BAPPCTSS
SCHEMBL14873586 0.81 ATM (0.46) ATMAPPCTSSCTSKCTSL
SCHEMBL2617260 0.80 ATM (0.39) ATMITGB3ITGA2BAPPCTSS
SCHEMBL20577875 0.80 ATM (0.54) ATMITGB3ITGA2BAPPCTSS
SCHEMBL20577877 0.80 ATM (0.54) ATMITGB3ITGA2BAPPCTSS
SCHEMBL18756384 0.80 CA1 (0.37) ATMCTSSCTSKTSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090286841-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. 2009-11-19 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-20090286841-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS KIF5B, KIF2C, PLK1 ATM 1110/4885ITGB3 4000/4885ITGA2B 4066/4885

“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.