SCHEMBL6664487

SCHEMBL6664487

COc1cccc(OCc2ccccc2)c1CNC(=O)c1cc2ccccc2[nH]1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.55
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
SRD5A2 P31213 2/20 0.53
SRD5A1 P18405 1/20 0.53
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
POLB P06746 1/20 0.53
PDGFRB P09619 1/20 0.49
PDGFRA P16234 1/20 0.49
FLT3 P36888 1/20 0.49
HDAC1 Q13547 2/20 0.49
HDAC3 O15379 1/20 0.48
HDAC2 Q92769 1/20 0.48
NCOR2 Q9Y618 1/20 0.48
MAPT P10636 1/20 0.48
MTNR1A P48039 1/20 0.48
MTNR1B P49286 1/20 0.48
ACKR3 P25106 1/20 0.48

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
SCHEMBL6661201 0.90 FLT3 (0.58) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6657213 0.84 FLT3 (0.54) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6657806 0.84 DRD2 (0.54) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6661461 0.79 ROCK2 (0.59) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6657726 0.78 GAA (0.53) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL2760020 0.78 KDM4E (0.58) KDM4EMEN1KMT2ASRD5A2SRD5A1
SCHEMBL6657486 0.78 MTNR1A (0.57) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6656183 0.78 MTNR1A (0.57) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL2735969 0.77 CA12 (0.72) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL3928684 0.77 FLT3 (0.52) KDM4EMEN1KMT2ANPC1RAB9A

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-1440966-A1 Indole derivatives useful for the treatment of diseases Pfizer Limited (GB) 2004-07-28 EP disclosed