SCHEMBL9407935

SCHEMBL9407935

O=C(ON1C(=O)CCC1=O)c1ccc(S(=O)(=O)N(C(=O)Oc2c3ccccc3nc3ccccc23)c2ccccc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.36
MAPK1 P28482 1/20 0.35
MAPT P10636 5/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
MGLL Q99685 1/20 0.34
ALDH1A1 P00352 5/20 0.34
KMT2A Q03164 4/20 0.33
KDM4E B2RXH2 3/20 0.33
MEN1 O00255 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
F2 P00734 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 2/20 0.33
GBA1 P04062 1/20 0.33
PKM P14618 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
CTSG P08311 1/20 0.32
CMA1 P23946 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
SCHEMBL8074295 0.94 MAPT (0.40) GAAMAPK1MAPTSMN1; SMN2ALDH1A1
SCHEMBL9407899 0.92 ALDH1A1 (0.43) GAAMAPTALDH1A1KMT2AF2
SCHEMBL9407963 0.83 MAPT (0.43) GAAMAPK1MAPTSMN1; SMN2ALDH1A1
SCHEMBL10691854 0.83 TAS2R14 (0.41) ALDH1A1KMT2AMEN1
Bromide SCHEMBL7464567 0.82 TAS2R14 (0.40) ALDH1A1KMT2AMEN1
SCHEMBL8470965 0.81 TP53 (0.44) GAAMAPTSMN1; SMN2ALDH1A1KMT2A
SCHEMBL7458558 0.80 MAPT (0.45) GAAMAPK1MAPTSMN1; SMN2ALDH1A1
SCHEMBL8079566 0.80 LMNA (0.37) GAAMAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL8074300 0.78 ALDH1A1 (0.40) GAAMAPTSMN1; SMN2ALDH1A1KMT2A
SCHEMBL9407932 0.77 LMNA (0.35) GAAMAPTSMN1; SMN2ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0602524-A1 Chemiluminescence marked sequences and their use in sequence testing HOECHST AKTIENGESELLSCHAFT (DE) 1994-06-22 EP disclosed