SCHEMBL6661736

SCHEMBL6661736

COc1ccc(CNC(=O)c2cc3ccccc3[nH]2)c(OC)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.64
MTNR1A P48039 1/20 0.62
MTNR1B P49286 1/20 0.62
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
NPC1 O15118 3/20 0.59
RAB9A P51151 3/20 0.59
TAS1R3 Q7RTX0 1/20 0.56
TAS1R1 Q7RTX1 1/20 0.56
PDGFRB P09619 2/20 0.56
PDGFRA P16234 2/20 0.56
FLT3 P36888 2/20 0.56
ALDH1A1 P00352 2/20 0.56
GAA P10253 2/20 0.56
PKM P14618 1/20 0.56
HPGD P15428 1/20 0.56
HTT P42858 1/20 0.56
MAPT P10636 5/20 0.56
DRD2 P14416 1/20 0.52
DRD3 P35462 1/20 0.52

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
SCHEMBL6661461 0.88 ROCK2 (0.59) KDM4EMTNR1AMTNR1BMEN1KMT2A
SCHEMBL4919678 0.86 FLT3 (0.61) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL2735834 0.86 FLT3 (0.61) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6657486 0.82 MTNR1A (0.57) KDM4EMTNR1AMTNR1BMEN1KMT2A
SCHEMBL6656183 0.82 MTNR1A (0.57) KDM4EMTNR1AMTNR1BMEN1KMT2A
SCHEMBL6661201 0.81 FLT3 (0.58) KDM4EMTNR1AMTNR1BMEN1KMT2A
SCHEMBL19476159 0.80 NPC1 (0.70) KDM4EMTNR1AMTNR1BMEN1KMT2A
SCHEMBL6658648 0.79 DRD2 (0.57) KDM4EMTNR1AMTNR1BTAS1R3TAS1R1
SCHEMBL6657806 0.79 DRD2 (0.54) KDM4EMTNR1AMTNR1BMEN1KMT2A
SCHEMBL8759043 0.78 HPGD (0.70) MEN1KMT2ATAS1R3TAS1R1ALDH1A1

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