SCHEMBL1503938

SCHEMBL1503938

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

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.49
MAPT P10636 1/20 0.41
KLK5 Q9Y337 3/20 0.40
CTSL P07711 1/20 0.39
KLK7 P49862 1/20 0.39
PPARA Q07869 1/20 0.39
CASP1 P29466 4/20 0.38
CTSK P43235 1/20 0.38
ATM Q13315 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
CTSS P25774 1/20 0.37
CASP3 P42574 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
SCHEMBL4366490 0.82 SYK (0.48) SYKMAPTKLK5CTSLKLK7
SCHEMBL1503843 0.82 SYK (0.57) SYKMAPTKLK5CTSLPPARA
SCHEMBL2186497 0.82 SYK (0.57) SYKMAPTKLK5CTSLPPARA
SCHEMBL263532 0.81 ATM (0.46) SYKCTSLCASP1CTSKATM
SCHEMBL1503940 0.79 SYK (0.49) SYKMAPTKLK5CTSLKLK7
SCHEMBL11026023 0.78 SYK (0.57) SYKMAPTKLK5CTSLKLK7
SCHEMBL10628673 0.78 SYK (0.57) SYKMAPTKLK5CTSLKLK7
SCHEMBL4356869 0.76 SYK (0.57) SYKMAPTKLK5CTSLKLK7
SCHEMBL10350971 0.76 KLK5 (0.57) SYKMAPTKLK5CTSLPPARA
SCHEMBL4363469 0.76 SYK (0.57) SYKMAPTKLK5CTSLKLK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110077266-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-03-31 US disclosed
US-20100093785-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2010-04-15 US disclosed
US-20050119486-A1 Diamine derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2005-06-02 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 (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-20100093785-A1 DIAMINE DERIVATIVES C9, C1S, C1R SYK 1675/4885MAPT 4343/4885KLK5 3666/4885
US-20050119486-A1 Diamine derivatives C9, C1S, C1R SYK 2089/4885MAPT 4271/4885KLK5 3922/4885
US-20110077266-A1 Diamine Derivatives F2, TFPI, F3 SYK 1228/4885MAPT 4302/4885KLK5 876/4885

“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.