SCHEMBL10636637

SCHEMBL10636637

CC(C)(C)C(O)COc1ccccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
HTT P42858 2/20 0.53
USP2 O75604 1/20 0.53
TDP1 Q9NUW8 2/20 0.49
CYP1A2 P05177 1/20 0.49
GAA P10253 1/20 0.49
CYP2C19 P33261 1/20 0.49
CASR P41180 1/20 0.48
RAB9A P51151 1/20 0.48
HPGD P15428 1/20 0.47
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.42
VDR P11473 6/20 0.42
AR P10275 4/20 0.42
MAPT P10636 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PKM P14618 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL1282702 0.81 L3MBTL1 (0.51) MEN1KMT2AHTTUSP2TDP1
SCHEMBL27730070 0.80 MEN1 (0.57) MEN1KMT2AHTTUSP2TDP1
SCHEMBL9037793 0.80 MEN1 (0.57) MEN1KMT2AHTTUSP2TDP1
SCHEMBL14027345 0.77 HTT (0.62) MEN1KMT2AHTTUSP2TDP1
SCHEMBL10717821 0.77 MEN1 (0.57) MEN1KMT2AHTTUSP2TDP1
SCHEMBL11201568 0.76 MAPT (0.68) MEN1KMT2AHTTUSP2CYP1A2
SCHEMBL22640075 0.76 MAPT (0.68) MEN1KMT2AHTTUSP2CYP1A2
SCHEMBL17040275 0.76 MEN1 (0.53) MEN1KMT2AHTTUSP2TDP1
SCHEMBL10314842 0.76 MEN1 (0.51) MEN1KMT2AHTTUSP2TDP1
SCHEMBL6481560 0.75 MEN1 (0.64) MEN1KMT2AHTTUSP2TDP1

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
US-4746673-A PHYTOPATHOGENS OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1988-05-24 US disclosed