SCHEMBL8722998

SCHEMBL8722998

O=C(O)CCN1C(=O)N(c2ccccc2)C(=O)C1c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
HPGD P15428 2/20 0.40
HTT P42858 1/20 0.40
KDM1A O60341 1/20 0.40
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
SMO Q99835 2/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 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
SCHEMBL10954783 0.92 GAA (0.47) GAAKDM4EALDH1A1TDP1SMN1; SMN2
SCHEMBL10950586 0.85 GAA (0.43) GAAKDM4EALDH1A1TDP1SMN1; SMN2
SCHEMBL9295944 0.82 SMO (0.39) GAAALDH1A1SMN1; SMN2LMNAHDAC1
SCHEMBL10335824 0.77 MEN1 (0.43) GAAKDM4EALDH1A1TDP1SMN1; SMN2
SCHEMBL10460433 0.77 SMO (0.39) GAASMN1; SMN2LMNAHDAC1HDAC6
SCHEMBL11337046 0.74 MEN1 (0.41) GAAKDM4EALDH1A1TDP1LMNA
SCHEMBL1561553 0.74 GAA (0.40) GAAKDM4EALDH1A1TDP1SMN1; SMN2
SCHEMBL5075815 0.73 MEN1 (0.41) GAAKDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL9295561 0.72 KDM1A (0.43) GAAALDH1A1SMN1; SMN2KDM1AMAPT
SCHEMBL11354993 0.72 SMN1; SMN2 (0.38) GAAALDH1A1SMN1; SMN2LMNAMAPT

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
US-5763191-A BINDING MATRIX BOEHRINGER MANNHEIM GMBH (DE) 1998-06-09 US disclosed
EP-0515615-B1 UNIVERSAL BINDING FILM BOEHRINGER MANNHEIM GMBH (DE) 1996-09-04 EP disclosed