SCHEMBL9368697

SCHEMBL9368697

O=C(O)CCCc1cn(C(=O)c2cccc(O)c2)c2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OXER1 Q8TDS5 1/20 0.56
HTR6 P50406 2/20 0.52
HTR1A P08908 1/20 0.52
HTR1D P28221 1/20 0.52
HTR1B P28222 1/20 0.52
HTR1F P30939 1/20 0.52
HTR7 P34969 1/20 0.52
MCL1 Q07820 4/20 0.45
PLA2G4A P47712 1/20 0.41
ADRA1D P25100 2/20 0.41
KMT2A Q03164 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.40
ADRA1A P35348 1/20 0.40
FABP4 P15090 1/20 0.40
FABP5 Q01469 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
THRB P10828 1/20 0.40
ALOX5 P09917 1/20 0.40

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
SCHEMBL5444461 0.89 OXER1 (0.64) OXER1HTR6HTR1AHTR1DHTR1B
SCHEMBL9154226 0.87 OXER1 (0.55) OXER1HTR6HTR1AHTR1DHTR1B
Hydrochloric Acid SCHEMBL9156117 0.86 OXER1 (0.54) OXER1HTR6HTR1AHTR1DHTR1B
SCHEMBL9156919 0.84 OXER1 (0.56) OXER1HTR6HTR1AHTR1DHTR1B
SCHEMBL9150530 0.83 OXER1 (0.58) OXER1HTR6HTR1AHTR1DHTR1B
SCHEMBL9370683 0.81 OXER1 (0.51) OXER1HTR6HTR1AHTR1DHTR1B
SCHEMBL10696303 0.81 OXER1 (0.56) OXER1HTR6HTR1AHTR1DHTR1B
SCHEMBL9154277 0.81 OXER1 (0.55) OXER1HTR6HTR1AHTR1DHTR1B
SCHEMBL9149567 0.80 OXER1 (0.48) OXER1HTR6HTR1AHTR1DHTR1B
SCHEMBL9369456 0.80 OXER1 (0.49) OXER1HTR6HTR1AHTR1DHTR1B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0600084-A1 INDOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-06-08 EP disclosed
WO-1993003012-A1 INDOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-02-18 WO disclosed