SCHEMBL14824331

SCHEMBL14824331

Bc1cc(C)c(OCc2ccccc2)cc1NC(=S)NC(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.57
CTDSP1 Q9GZU7 1/20 0.57
EPHX1 P07099 3/20 0.53
ALDH1A1 P00352 8/20 0.51
MAPT P10636 7/20 0.51
RAB9A P51151 4/20 0.51
NPC1 O15118 3/20 0.51
NPSR1 Q6W5P4 2/20 0.51
RXFP1 Q9HBX9 1/20 0.51
MEN1 O00255 9/20 0.51
KMT2A Q03164 9/20 0.51
KDM4E B2RXH2 2/20 0.49
ALOX12 P18054 2/20 0.49
HPGD P15428 1/20 0.49
POLB P06746 3/20 0.47
GPR55 Q9Y2T6 1/20 0.47
GAA P10253 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL3663990 0.87 TDP1 (0.57) TDP1CTDSP1EPHX1ALDH1A1MAPT
SCHEMBL8296751 0.77 EPHX1 (0.68) TDP1CTDSP1EPHX1ALDH1A1MAPT
SCHEMBL8612483 0.73 EPHX1 (0.77) TDP1EPHX1ALDH1A1MAPTRAB9A
SCHEMBL4365347 0.73 KMT2A (0.54) TDP1CTDSP1EPHX1ALDH1A1MAPT
SCHEMBL2338840 0.72 PPIA (0.61) RAB9ANPC1NPSR1
SCHEMBL8615334 0.71 EPHX1 (0.68) TDP1CTDSP1EPHX1ALDH1A1MAPT
SCHEMBL11492866 0.71 RAB9A (0.75) TDP1EPHX1ALDH1A1MAPTRAB9A
SCHEMBL19128666 0.71 KMT2A (0.49) TDP1CTDSP1EPHX1ALDH1A1MAPT
SCHEMBL191773 0.71 NPC1 (0.53) TDP1CTDSP1EPHX1ALDH1A1MAPT
SCHEMBL2340858 0.71 NPC1 (0.68) TDP1CTDSP1EPHX1ALDH1A1MAPT

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-2231653-B1 ANTIBACTERIAL CONDENSED THIAZOLES BIOTA EUROPE LTD (GB) 2013-04-03 EP disclosed