SCHEMBL9025580

SCHEMBL9025580

COc1c(Cc2c[nH]c3ccccc23)[nH]c(=O)c(C2CCCCC2)[n+]1[O-]

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.43
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
ALDH1A1 P00352 3/20 0.43
BCHE P06276 4/20 0.40
ACHE P22303 1/20 0.40
KMT2A Q03164 6/20 0.39
GPR84 Q9NQS5 3/20 0.39
HTT P42858 2/20 0.39
POLB P06746 2/20 0.39
TP53 P04637 1/20 0.39
AHR P35869 3/20 0.39
MEN1 O00255 3/20 0.39
CYP3A4 P08684 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KDM4E B2RXH2 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MAPK1 P28482 1/20 0.37
HPGD P15428 1/20 0.36

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
SCHEMBL9025377 0.85 BCHE (0.43) MAPTLMNASMN1; SMN2ALDH1A1BCHE
SCHEMBL9025592 0.81 GPR84 (0.45) MAPTSMN1; SMN2ALDH1A1KMT2AGPR84
SCHEMBL9026577 0.80 GPR84 (0.44) MAPTSMN1; SMN2ALDH1A1KMT2AGPR84
SCHEMBL9026744 0.78 KMT2A (0.49) MAPTLMNASMN1; SMN2ALDH1A1KMT2A
SCHEMBL9025829 0.77 MAPT (0.42) MAPTALDH1A1KMT2AGPR84POLB
SCHEMBL9026242 0.77 GPR84 (0.41) MAPTALDH1A1KMT2AGPR84POLB
SCHEMBL9026776 0.77 KMT2A (0.44) MAPTLMNAALDH1A1KMT2AGPR84
SCHEMBL9037121 0.76 KCNA5 (0.41) MAPTLMNASMN1; SMN2ALDH1A1BCHE
SCHEMBL9025614 0.75 AHR (0.41) MAPTSMN1; SMN2KMT2AGPR84POLB
SCHEMBL9026860 0.72 KMT2A (0.42) MAPTLMNASMN1; SMN2ALDH1A1BCHE

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