SCHEMBL9263271

SCHEMBL9263271

COc1cccc(OCC(=O)NCc2ccccc2)c1OC

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.68
RAB9A P51151 1/20 0.64
KMT2A Q03164 4/20 0.62
PKM P14618 1/20 0.62
NPSR1 Q6W5P4 1/20 0.60
HPGD P15428 3/20 0.60
HSD17B10 Q99714 1/20 0.58
GAA P10253 2/20 0.57
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.56
HTT P42858 1/20 0.56
TP53 P04637 1/20 0.56
GLA P06280 1/20 0.56
KDM4E B2RXH2 1/20 0.55
MEN1 O00255 1/20 0.54
UBE2N P61088 1/20 0.54
PDE4D Q08499 1/20 0.53

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
SCHEMBL29954842 0.83 KMT2A (0.59) SMN1; SMN2RAB9AKMT2APKMNPSR1
SCHEMBL24590651 0.81 SMN1; SMN2 (1.00) SMN1; SMN2RAB9AKMT2ANPSR1HPGD
SCHEMBL3185330 0.79 HPGD (0.78) SMN1; SMN2RAB9AKMT2APKMNPSR1
SCHEMBL31552456 0.79 SMN1; SMN2 (0.71) SMN1; SMN2KMT2AHPGDHSD17B10ALDH1A1
SCHEMBL9267938 0.78 HCRTR2 (0.65) SMN1; SMN2KMT2APKMHPGDMEN1
SCHEMBL9270069 0.77 POLB (0.50) SMN1; SMN2KMT2ANPSR1HPGDHSD17B10
SCHEMBL9275347 0.77 SMN1; SMN2 (0.72) SMN1; SMN2RAB9AKMT2ANPSR1HPGD
SCHEMBL29957873 0.77 ALDH1A1 (0.72) SMN1; SMN2RAB9AKMT2APKMNPSR1
SCHEMBL5462136 0.77 HPGD (0.61) SMN1; SMN2RAB9AKMT2APKMHPGD
SCHEMBL2719871 0.77 KMT2A (0.67) SMN1; SMN2RAB9AKMT2APKMHPGD

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
WO-1995029155-A1 NOVEL ANTITUMOUR COMPOUNDS WITH ANTIMITOTIC ACTIVITY PHARMACIA AB (SE) 1995-11-02 WO disclosed