SCHEMBL9027299

SCHEMBL9027299

C[C@H]1C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.62
MAPT P10636 4/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
TP53 P04637 1/20 0.61
GLA P06280 1/20 0.61
CYP3A4 P08684 1/20 0.61
THRB P10828 1/20 0.61
RIPK1 Q13546 1/20 0.61
HSD17B10 Q99714 1/20 0.61
KMT2A Q03164 6/20 0.58
MEN1 O00255 4/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
LMNA P02545 2/20 0.57
PKM P14618 1/20 0.57
POLB P06746 2/20 0.56
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
HPGD P15428 1/20 0.56
TNF P01375 1/20 0.54
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL7827097 0.83 KMT2A (0.68) IDO1MAPTSMN1; SMN2TP53GLA
SCHEMBL7815529 0.83 KMT2A (0.68) IDO1MAPTSMN1; SMN2TP53GLA
SCHEMBL9027171 0.82 IDO1 (0.56) IDO1MAPTSMN1; SMN2TP53GLA
SCHEMBL9026062 0.82 IDO1 (0.56) IDO1MAPTSMN1; SMN2TP53GLA
SCHEMBL12368076 0.82 KMT2A (0.60) IDO1MAPTSMN1; SMN2TP53GLA
SCHEMBL12809540 0.82 IDO1 (0.76) IDO1MAPTSMN1; SMN2TP53GLA
SCHEMBL13399673 0.82 IDO1 (0.76) IDO1MAPTSMN1; SMN2TP53GLA
SCHEMBL14595068 0.82 IDO1 (0.76) IDO1MAPTSMN1; SMN2TP53GLA
SCHEMBL2042419 0.82 IDO1 (0.76) IDO1MAPTSMN1; SMN2TP53GLA
SCHEMBL17867048 0.82 IDO1 (0.76) IDO1MAPTSMN1; SMN2TP53GLA

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