SCHEMBL299977

SCHEMBL299977

CC(=O)ONNC(=O)NCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.54
PTPN1 P18031 2/20 0.53
ALDH1A1 P00352 4/20 0.51
KDM4E B2RXH2 1/20 0.51
GAA P10253 1/20 0.51
MAPT P10636 2/20 0.50
EPHX1 P07099 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
PPID Q08752 1/20 0.50
CFD P00746 1/20 0.49
TP53 P04637 1/20 0.49
ATM Q13315 1/20 0.48
EPHX2 P34913 1/20 0.47
POLB P06746 1/20 0.47
CYP2C9 P11712 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
SCHEMBL4197745 0.82 PPID (0.52) SMN1; SMN2PTPN1ALDH1A1KDM4EGAA
SCHEMBL5499261 0.80 ALDH1A1 (0.48) SMN1; SMN2PTPN1ALDH1A1GAAMAPT
SCHEMBL4188819 0.78 SMN1; SMN2 (0.62) SMN1; SMN2PTPN1ALDH1A1KDM4EGAA
SCHEMBL714625 0.76 EPHX1 (0.77) SMN1; SMN2PTPN1ALDH1A1KDM4EGAA
SCHEMBL3614552 0.75 ALDH1A1 (0.52) SMN1; SMN2PTPN1ALDH1A1KDM4EGAA
SCHEMBL969258 0.73 SMN1; SMN2 (0.67) SMN1; SMN2PTPN1ALDH1A1GAAMAPT
SCHEMBL6033584 0.73 TP53 (0.75) SMN1; SMN2PTPN1ALDH1A1KDM4EGAA
SCHEMBL97001 0.73 KMT2A (0.68) SMN1; SMN2PTPN1ALDH1A1GAAMAPT
SCHEMBL9461525 0.73 MAPT (0.64) SMN1; SMN2PTPN1ALDH1A1GAAMAPT
SCHEMBL8790488 0.73 SMN1; SMN2 (0.61) SMN1; SMN2PTPN1ALDH1A1KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2427451-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BioLab Corporation (JP) 2012-03-14 EP disclosed
EP-2303887-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO Prism Biolab Corporation (JP) 2011-04-06 EP disclosed