SCHEMBL15526544

SCHEMBL15526544

CCOC(=O)C(OS(=O)(=O)c1ccccc1)C(C)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
NPC1 O15118 2/20 0.45
ATM Q13315 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
RAB9A P51151 1/20 0.43
PIN1 Q13526 1/20 0.43
HTT P42858 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TSHR P16473 1/20 0.42
MAPT P10636 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41
HSD11B1 P28845 1/20 0.41
CA12 O43570 4/20 0.40
CA1 P00915 4/20 0.40
CA2 P00918 4/20 0.40
CA9 Q16790 4/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL6157269 0.88 KMT2A (0.44) KMT2AMEN1SMN1; SMN2TSHRHSD17B10
SCHEMBL9017494 0.84 LMNA (0.47) KMT2AMEN1NPC1ATMSMN1; SMN2
SCHEMBL15526543 0.79 ALDH1A1 (0.44) KMT2AMEN1NPC1ATMSMN1; SMN2
SCHEMBL6157248 0.78 KMT2A (0.39) KMT2AMEN1SMN1; SMN2TSHRHSD17B10
SCHEMBL23249536 0.77 SMN1; SMN2 (0.41) KMT2ASMN1; SMN2RAB9ANPSR1TSHR
SCHEMBL29654897 0.77 SMN1; SMN2 (0.41) KMT2ASMN1; SMN2RAB9ANPSR1TSHR
SCHEMBL23249535 0.77 SMN1; SMN2 (0.41) KMT2ASMN1; SMN2RAB9ANPSR1TSHR
SCHEMBL6155399 0.76 PLA2G2C (0.41) KMT2AMEN1NPC1SMN1; SMN2RAB9A
SCHEMBL29542939 0.76 HPGD (0.47) KMT2AMEN1RAB9ANPSR1MAPT
SCHEMBL29543339 0.76 HPGD (0.47) KMT2AMEN1RAB9ANPSR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2844634-A1 NEW INTERMEDIATE COMPOUND FOR PREPARING VITAMIN B6 DSM IP Assets B.V. (NL) 2015-03-11 EP claimed
WO-2013163889-A1 NEW INTERMEDIATE COMPOUND FOR PREPARING VITAMIN B6 DSM IP ASSETS B.V. (NL) 2013-11-07 WO claimed
EP-2844634-A1 NEW INTERMEDIATE COMPOUND FOR PREPARING VITAMIN B6 DSM IP Assets B.V. (NL) 2015-03-11 EP disclosed
WO-2013163889-A1 NEW INTERMEDIATE COMPOUND FOR PREPARING VITAMIN B6 DSM IP ASSETS B.V. (NL) 2013-11-07 WO disclosed