SCHEMBL13083064

SCHEMBL13083064

Cc1c(F)cc(N)c(O)c1C(=O)Oc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.48
MAPT P10636 7/20 0.47
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
CHRM1 P11229 1/20 0.47
TBXA2R P21731 1/20 0.47
SLC6A2 P23975 1/20 0.47
PDE4A P27815 1/20 0.47
ADRA1A P35348 1/20 0.47
KDR P35968 1/20 0.47
SLC6A3 Q01959 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HPGD P15428 2/20 0.43
ALOX15 P16050 2/20 0.43
HSD17B10 Q99714 2/20 0.43
RAB9A P51151 2/20 0.40
NPSR1 Q6W5P4 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
SCHEMBL18602956 0.87 NSD2 (0.51) NSD2MAPTLMNASMN1; SMN2TP53
SCHEMBL15086697 0.86 NSD2 (0.50) NSD2MAPTLMNASMN1; SMN2TP53
SCHEMBL13064206 0.83 NSD2 (0.48) NSD2MAPTLMNASMN1; SMN2TP53
SCHEMBL114127 0.83 NSD2 (0.48) NSD2MAPTLMNASMN1; SMN2TP53
SCHEMBL13397787 0.82 NSD2 (0.47) NSD2MAPTLMNASMN1; SMN2TP53
SCHEMBL113312 0.79 ALOX5 (0.46) NSD2MAPTLMNASMN1; SMN2TP53
SCHEMBL113286 0.79 PTPN1 (0.42) MAPTLMNASMN1; SMN2TP53CYP3A4
SCHEMBL6128435 0.78 FAAH (0.40) MAPTLMNASMN1; SMN2TP53CYP3A4
SCHEMBL18602514 0.77 NSD2 (0.43) NSD2MAPTLMNASMN1; SMN2TP53
SCHEMBL113401 0.77 HSD17B10 (0.51) NSD2MAPTLMNASMN1; SMN2TP53

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-2010129057-A2 TETRACYCLINE COMPOUNDS TETRAPHASE PHARMACEUTICALS, INC. (US) 2010-11-11 WO disclosed