SCHEMBL1054435

SCHEMBL1054435

CC(C)(C)[Si](C)(C)OC(CO)CNC(=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.48
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
LMNA P02545 2/20 0.45
ATM Q13315 1/20 0.44
MAPT P10636 1/20 0.43
CTSS P25774 4/20 0.42
CTSL P07711 2/20 0.42
CTSB P07858 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
CTSK P43235 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL11886701 0.91 SYK (0.54) SYKHTTSMN1; SMN2LMNAATM
SCHEMBL28766687 0.91 SYK (0.48) SYKHTTSMN1; SMN2LMNAATM
SCHEMBL30500895 0.88 SYK (0.60) SYKHTTSMN1; SMN2LMNAATM
SCHEMBL18654075 0.83 SYK (0.48) SYKHTTSMN1; SMN2LMNAATM
SCHEMBL11886704 0.82 SYK (0.47) SYKHTTSMN1; SMN2LMNAATM
SCHEMBL1022651 0.81 SYK (0.53) SYKMAPTCTSSCTSLCTSB
SCHEMBL1022650 0.81 SYK (0.53) SYKMAPTCTSSCTSLCTSB
SCHEMBL6989963 0.79 GRIN2D (0.47) HTTSMN1; SMN2LMNAMAPK1
SCHEMBL12703535 0.79 KMT2A (0.46) CTSK
SCHEMBL21383878 0.79 HTT (0.50) HTTSMN1; SMN2LMNAATMMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120189623-A1 CYCLIZED DERIVATIVES AS EG-5 INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2012-07-26 US disclosed
US-20120189623-A1 CYCLIZED DERIVATIVES AS EG-5 INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2012-07-26 US disclosed
US-20110003791-A1 Cyclized Derivatives as EG-5 Inhibitors NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2011-01-06 US disclosed
US-20110003791-A1 Cyclized Derivatives as EG-5 Inhibitors NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2011-01-06 US disclosed
US-7820646-B2 Cyclized derivatives as Eg-5 inhibitors NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-10-26 US disclosed
US-7820646-B2 Cyclized derivatives as Eg-5 inhibitors NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-10-26 US disclosed
EP-2106399-A2 IMIDAZOLE DERIVATIVES AS KINESIN SPINDLE PROTEIN INHIBITORS (EG-5) Novartis AG (CH) 2009-10-07 EP disclosed
US-20080207589-A1 CYCLIZED DERIVATIVES AS EG-5 INHIBITORS NOVARTIS AG 2008-08-28 US disclosed
US-20080207589-A1 CYCLIZED DERIVATIVES AS EG-5 INHIBITORS NOVARTIS AG 2008-08-28 US disclosed
WO-2008086122-A2 IMIDAZOLE DERIVATIVES AS KINESIN SPINDLE PROTEIN INHIBITORS (EG-5) NOVARTIS AG (CH) 2008-07-17 WO 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 (3 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-20110003791-A1 Cyclized Derivatives as EG-5 Inhibitors CYP3A5, GDI2, HDAC5 SYK 4132/4885HTT 1665/4885SMN1; SMN2 4796/4885
US-20120189623-A1 CYCLIZED DERIVATIVES AS EG-5 INHIBITORS CYP3A5, GDI2, HDAC5 SYK 4132/4885HTT 1665/4885SMN1; SMN2 4796/4885
US-20080207589-A1 CYCLIZED DERIVATIVES AS EG-5 INHIBITORS CYP3A5, GDI2, HDAC5 SYK 4132/4885HTT 1665/4885SMN1; SMN2 4796/4885

“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.