SCHEMBL9751050

SCHEMBL9751050

CSCC[C@@H](C(=O)O)N(c1ccccc1)N1CC(=O)NC1=S

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
ALOX15 P16050 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 3/20 0.34
MAPK1 P28482 2/20 0.34
MEN1 O00255 2/20 0.34
MAPT P10636 1/20 0.34
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP13 P45452 1/20 0.33
BCL2 P10415 1/20 0.33
BCL2L2 Q92843 1/20 0.33
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
GAA P10253 3/20 0.32
ALDH1A1 P00352 2/20 0.32
CCR1 P32246 1/20 0.32
ACE P12821 1/20 0.32

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
SCHEMBL9751047 0.76 KDM4E (0.45) KDM4EALOX15SMN1; SMN2KMT2AMAPK1
SCHEMBL29245840 0.75 KDM4E (0.39) KDM4EALOX15KMT2AFNTAFNTB
SCHEMBL9751048 0.69 KDM4E (0.33) KDM4EALOX15SMN1; SMN2KMT2AMAPK1
SCHEMBL28294332 0.67 ALDH1A1 (0.39) KDM4EALOX15SMN1; SMN2KMT2AMEN1
SCHEMBL15922647 0.66 KDM4E (0.41) KDM4EALOX15SMN1; SMN2KMT2AMEN1
SCHEMBL6681598 0.66 ANPEP (0.42) KMT2AMEN1FNTAFNTBGAA
SCHEMBL27768608 0.66 ANPEP (0.42) KMT2AMEN1FNTAFNTBGAA
SCHEMBL10585916 0.64 ALDH1A1 (0.39) KDM4EALOX15SMN1; SMN2KMT2AMEN1
SCHEMBL29145850 0.64 PPID (0.37) KDM4EALOX15SMN1; SMN2KMT2AMAPK1
SCHEMBL9082541 0.63 LMNA (0.43) KMT2AMEN1FNTAFNTBALDH1A1

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
EP-0347435-A4 DNA SEQUENCES, RECOMBINANT DNA MOLECULES AND PROCESSES FOR PRODUCING SOLUBLE T4 PROTEINS 1991-11-21 EP disclosed
EP-0347435-A1 DNA SEQUENCES, RECOMBINANT DNA MOLECULES AND PROCESSES FOR PRODUCING SOLUBLE T4 PROTEINS BIOGEN, INC. (US) 1989-12-27 EP disclosed
WO-1989001940-A1 DNA SEQUENCES, RECOMBINANT DNA MOLECULES AND PROCESSES FOR PRODUCING SOLUBLE T4 PROTEINS BIOGEN, INC. (US) 1989-03-09 WO disclosed