SCHEMBL9026979

SCHEMBL9026979

COc1nc(Cc2c[nH]c3ccccc23)c(OC)[n+]([O-])c1CC(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 5/20 0.41
HTR2A P28223 3/20 0.40
MAPT P10636 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
AHR P35869 2/20 0.40
HTR1A P08908 2/20 0.40
ADRB1 P08588 1/20 0.40
ADRA2A P08913 1/20 0.40
SLC6A2 P23975 1/20 0.40
HTR1D P28221 1/20 0.40
HTR1B P28222 1/20 0.40
HTR2C P28335 1/20 0.40
HTR1E P28566 1/20 0.40
SLC6A4 P31645 1/20 0.40
HTR7 P34969 1/20 0.40
HTR2B P41595 1/20 0.40
HTR6 P50406 1/20 0.40
SLC6A3 Q01959 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
SCHEMBL9026185 0.90 GPR84 (0.41) GPR84HTR2AMAPTMEN1KMT2A
SCHEMBL9026147 0.90 KMT2A (0.40) GPR84HTR2AMAPTMEN1KMT2A
SCHEMBL9027409 0.90 MAPT (0.42) GPR84MAPTMEN1KMT2ATDP1
SCHEMBL9025873 0.89 GPR84 (0.41) GPR84HTR2AMAPTMEN1KMT2A
SCHEMBL9027306 0.86 TACR1 (0.41) MAPTKDM4EAPAF1POLBRECQL
SCHEMBL9026275 0.84 GPR84 (0.42) GPR84HTR2AMAPTMEN1KMT2A
SCHEMBL9026638 0.81 KMT2A (0.39) GPR84HTR2AMAPTMEN1KMT2A
SCHEMBL9026588 0.81 GPR84 (0.49) GPR84HTR2AMAPTMEN1KMT2A
SCHEMBL9025363 0.81 LTA4H (0.46) GPR84MAPTMEN1KMT2AHTR1A
SCHEMBL9027482 0.81 PCSK9 (0.38) GPR84MAPTMEN1KMT2AHTR1D

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 3 patents. 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
US-5238938-A Nephrosis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-08-24 US disclosed
EP-0411150-A1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-02-06 EP disclosed