SCHEMBL9514878

SCHEMBL9514878

O=C(O)C(Cc1ccccc1)N1CCOCC1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
PKM P14618 1/20 0.55
MAPT P10636 2/20 0.51
ALOX15 P16050 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.48
HSD17B10 Q99714 3/20 0.48
NPSR1 Q6W5P4 1/20 0.48
KMT2A Q03164 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
POLB P06746 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
PTPN7 P35236 1/20 0.46
RECQL P46063 1/20 0.46
BLM P54132 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL9514909 0.86 MEN1 (0.49) ALDH1A1PKMMAPTLMNANPSR1
SCHEMBL7334247 0.81 ALDH1A1 (0.77) ALDH1A1PKMMAPTALOX15SMN1; SMN2
SCHEMBL908487 0.80 LMNA (0.55) ALDH1A1PKMMAPTALOX15SMN1; SMN2
SCHEMBL9074064 0.78 ALDH1A1 (0.63) ALDH1A1PKMMAPTALOX15SMN1; SMN2
SCHEMBL6571504 0.78 ALDH1A1 (0.63) ALDH1A1PKMMAPTALOX15SMN1; SMN2
SCHEMBL19621077 0.78 ALDH1A1 (0.63) ALDH1A1PKMMAPTALOX15SMN1; SMN2
SCHEMBL7280926 0.78 LMNA (0.68) ALDH1A1PKMMAPTALOX15SMN1; SMN2
SCHEMBL9516925 0.78 LMNA (0.68) ALDH1A1PKMMAPTALOX15SMN1; SMN2
SCHEMBL27312976 0.78 MMP8 (0.38) ALDH1A1PKMLMNANPSR1KMT2A
SCHEMBL9074197 0.77 ALDH1A1 (0.61) ALDH1A1PKMMAPTALOX15SMN1; SMN2

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