SCHEMBL9026744

SCHEMBL9026744

COc1c(Cc2c[nH]c3ccccc23)[nH]c(=O)c(Cc2ccccc2)[n+]1[O-]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.49
MEN1 O00255 7/20 0.49
AHR P35869 3/20 0.44
GPR84 Q9NQS5 3/20 0.42
SLC6A2 P23975 1/20 0.41
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 3/20 0.41
CYP3A4 P08684 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
HTR6 P50406 1/20 0.40
TACR1 P25103 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
CDK4 P11802 1/20 0.38
KDM4E B2RXH2 4/20 0.38
TRPM8 Q7Z2W7 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
APAF1 O14727 1/20 0.38

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
SCHEMBL9025592 0.94 GPR84 (0.45) KMT2AMEN1AHRGPR84MAPT
SCHEMBL9025614 0.92 AHR (0.41) KMT2AMEN1AHRGPR84SLC6A2
SCHEMBL9026776 0.92 KMT2A (0.44) KMT2AMEN1AHRGPR84SLC6A2
SCHEMBL9026194 0.92 ECE1 (0.42) KMT2AMEN1AHRGPR84LMNA
SCHEMBL9026577 0.89 GPR84 (0.44) KMT2AMEN1AHRGPR84MAPT
SCHEMBL9025829 0.87 MAPT (0.42) KMT2AMEN1AHRGPR84SLC6A2
SCHEMBL29546665 0.84 RNASEH1 (0.40) KMT2ALMNAPOLBALDH1A1TSHR
SCHEMBL9027240 0.84 KMT2A (0.52) KMT2AMEN1AHRGPR84SLC6A2
SCHEMBL9025377 0.82 BCHE (0.43) KMT2AMEN1AHRGPR84LMNA
SCHEMBL9164176 0.81 GPR84 (0.43) KMT2AMEN1AHRGPR84SLC6A2

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