SCHEMBL4366490

SCHEMBL4366490

CC(C)(C)OC(=O)N[C@H](CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)[C@@H](CC(=O)O)NC(=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.48
PPARA Q07869 2/20 0.46
CTSS P25774 2/20 0.44
MAPT P10636 1/20 0.44
KLK5 Q9Y337 3/20 0.43
PPARG P37231 1/20 0.42
CASP1 P29466 7/20 0.42
CTSK P43235 2/20 0.41
KLK7 P49862 1/20 0.41
CTSL P07711 1/20 0.41
CTSB P07858 1/20 0.41
ATM Q13315 1/20 0.40

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
SCHEMBL1503935 0.91 SYK (0.48) SYKPPARACTSSMAPTKLK5
SCHEMBL1503940 0.84 SYK (0.49) SYKPPARACTSSMAPTKLK5
SCHEMBL25401074 0.83 ATM (0.47) SYKCTSSCTSKCTSLCTSB
SCHEMBL25401078 0.83 ATM (0.47) SYKCTSSCTSKCTSLCTSB
SCHEMBL261847 0.83 SYK (0.48) SYKCTSSCASP1CTSKCTSL
SCHEMBL263533 0.83 ATM (0.46) SYKCTSSCTSKCTSLCTSB
SCHEMBL1503938 0.82 SYK (0.49) SYKPPARACTSSMAPTKLK5
SCHEMBL10350971 0.82 KLK5 (0.57) SYKPPARACTSSMAPTKLK5
SCHEMBL4363469 0.82 SYK (0.57) SYKPPARACTSSMAPTKLK5
SCHEMBL4356869 0.82 SYK (0.57) SYKPPARACTSSMAPTKLK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1405852-B9 DIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2013-03-27 EP disclosed
EP-1405852-B1 DIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2012-08-01 EP disclosed
US-20110312990-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-22 US disclosed
US-20090270446-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-10-29 US disclosed
US-7365205-B2 Cyclic diamine derivatives useful as agents for preventing and/or treating cerebral infarction, cerebral embolism, myocardial infarction, angina pectoris, pulmonary infarction, pulmonary embolism; inhibit activated blood coagulation factor X DAIICHI SANKYO COMPANY, LIMITED (JP) 2008-04-29 US disclosed
US-7342014-B2 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-03-11 US disclosed
US-20080015215-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-01-17 US disclosed
US-20050245565-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-03 US disclosed
US-20050020645-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-01-27 US disclosed
EP-1415992-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 EP disclosed
EP-1405852-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-07 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 (5 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-20090270446-A1 DIAMINE DERIVATIVES F2, TFPI, F3 SYK 1228/4885PPARA 3468/4885CTSS 2612/4885
US-20050020645-A1 Diamine derivatives C9, C1S, C1R SYK 2089/4885PPARA 4308/4885CTSS 2175/4885
US-20080015215-A1 DIAMINE DERIVATIVES C9, C1S, C1R SYK 2089/4885PPARA 4308/4885CTSS 2175/4885
US-20050245565-A1 Diamine derivatives C9, C1S, C1R SYK 2089/4885PPARA 4308/4885CTSS 2175/4885
US-20110312990-A1 Diamine Derivatives C9, C1S, C1R SYK 1979/4885PPARA 4353/4885CTSS 2311/4885

“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.