SCHEMBL9514522

SCHEMBL9514522

CSC[C@H](N)C(=O)O.O=C(O)[C@H](Cc1ccccc1)NC(=O)N1CCOCC1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.58
CTSL P07711 3/20 0.54
KMT2A Q03164 2/20 0.54
CTSS P25774 5/20 0.52
CTSB P07858 2/20 0.49
GFER P55789 1/20 0.49
TACR2 P21452 2/20 0.48
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
HSD17B10 Q99714 1/20 0.47
GAA P10253 1/20 0.47

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
SCHEMBL9514870 0.92 POLB (0.56) POLBCTSLKMT2ACTSSCTSB
SCHEMBL5193787 0.88 POLB (0.74) POLBCTSLKMT2ACTSSCTSB
SCHEMBL7275964 0.88 POLB (0.74) POLBCTSLKMT2ACTSSCTSB
Norvaline SCHEMBL9514591 0.87 POLB (0.58) POLBCTSLKMT2ACTSSCTSB
Leucine SCHEMBL1406330 0.87 CTSS (0.62) POLBCTSLKMT2ACTSSCTSB
Leucine SCHEMBL3812485 0.85 CTSS (0.59) POLBCTSLKMT2ACTSSCTSB
SCHEMBL7607635 0.84 POLB (0.66) POLBCTSLKMT2ACTSSCTSB
SCHEMBL6795468 0.82 POLB (0.65) POLBCTSLKMT2ACTSSCTSB
SCHEMBL9515722 0.82 POLB (0.56) POLBCTSLKMT2ACTSSCTSB
SCHEMBL23489726 0.81 CTSL (0.62) POLBCTSLKMT2ACTSSCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0266950-B1 Nor-statine and nor-cyclostatine polypeptides PFIZER (US) 1993-12-29 EP disclosed
US-5034376-A Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1991-07-23 US disclosed
US-4935405-A Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1990-06-19 US disclosed
US-4814342-A Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1989-03-21 US disclosed
EP-0266950-A2 Nor-statine and nor-cyclostatine polypeptides PFIZER INC. (US) 1988-05-11 EP disclosed