SCHEMBL9026402

SCHEMBL9026402

COc1ccc2[nH]cc(Cc3nc(OCc4ccccc4)c(CC(C)C)[n+]([O-])c3OC)c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.45
AHR P35869 1/20 0.42
LTA4H P09960 2/20 0.42
PLA2G2A P14555 2/20 0.42
MEN1 O00255 1/20 0.42
HSP90AA1 P07900 1/20 0.42
HSP90AB1 P08238 1/20 0.42
KMT2A Q03164 1/20 0.42
HTR2A P28223 3/20 0.42
HTR1A P08908 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
HTR1D P28221 3/20 0.42
TRPM8 Q7Z2W7 2/20 0.42
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
MTNR1B P49286 1/20 0.41
HTR6 P50406 1/20 0.41
SLC6A4 P31645 1/20 0.41
MTNR1A P48039 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
SCHEMBL9025363 0.97 LTA4H (0.46) GPR84LTA4HPLA2G2AMEN1HSP90AA1
SCHEMBL9027482 0.92 PCSK9 (0.38) GPR84LTA4HPLA2G2AMEN1HSP90AA1
SCHEMBL9026147 0.91 KMT2A (0.40) GPR84AHRMEN1KMT2AHTR2A
SCHEMBL9027221 0.89 PDE10A (0.36) LTA4HPLA2G2AMEN1HSP90AA1HSP90AB1
SCHEMBL9026638 0.83 KMT2A (0.39) GPR84AHRMEN1KMT2AHTR2A
SCHEMBL9026084 0.83 KCNA5 (0.38) GPR84MEN1KMT2AHTR1D
SCHEMBL9026872 0.83 SOS2 (0.38) LTA4HPLA2G2AHTR2ATRPM8MAPT
SCHEMBL9027273 0.82 KMT2A (0.38) GPR84MEN1KMT2AHTR2AHTR1A
SCHEMBL9026979 0.81 GPR84 (0.41) GPR84AHRMEN1KMT2AHTR2A
SCHEMBL9027253 0.79 KMT2A (0.40) GPR84AHRMEN1KMT2AHTR2A

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-0411150-B1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMA CO LTD (JP) 1996-11-27 EP disclosed