SCHEMBL5316637

SCHEMBL5316637

CN(C)c1cccc2c1C(=O)OC21c2cc(Cl)c(O)cc2Oc2cc(O)c(Cl)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 6/20 0.41
HPGD P15428 3/20 0.41
MAPT P10636 3/20 0.41
TDP1 Q9NUW8 3/20 0.41
MEN1 O00255 2/20 0.41
HTT P42858 2/20 0.41
KMT2A Q03164 2/20 0.41
SMAD3 P84022 2/20 0.41
RECQL P46063 2/20 0.41
CYP2C19 P33261 1/20 0.41
BLM P54132 1/20 0.41
PRMT1 Q99873 1/20 0.41
ACE2 Q9BYF1 1/20 0.41
ALDH1A1 P00352 4/20 0.40
BRCA1 P38398 2/20 0.40
HSD17B10 Q99714 2/20 0.40
CYP2C9 P11712 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
DHFR P00374 3/20 0.38

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
SCHEMBL5316383 0.83 FTO (0.60) FTOHPGDMAPTTDP1MEN1
SCHEMBL1468956 0.80 ALDH1A1 (0.40) FTOHPGDMAPTTDP1MEN1
SCHEMBL4278233 0.80 DHFR (0.39) FTOHPGDMAPTTDP1MEN1
SCHEMBL5029405 0.80 MAPT (0.45) FTOHPGDMAPTTDP1MEN1
SCHEMBL19211134 0.79 DHFR (0.47) FTOHPGDMAPTTDP1MEN1
SCHEMBL6338860 0.78 LCK (0.39) FTOHPGDMAPTTDP1MEN1
SCHEMBL1689593 0.78 ALDH1A1 (0.44) FTOHPGDMAPTTDP1MEN1
Dichlorofluorescein SCHEMBL30606648 0.76 MAPT (0.64) FTOHPGDMAPTTDP1MEN1
Dichlorofluorescein SCHEMBL29364373 0.76 MAPT (0.64) FTOHPGDMAPTTDP1MEN1
Dichlorofluorescein SCHEMBL157703 0.76 MAPT (0.64) FTOHPGDMAPTTDP1MEN1

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-2007071927-A2 FLUORESCENT DYES AND COMPLEXES CAMBRIDGE ENTERPRISE LIMITED (GB) 2007-06-28 WO disclosed