SCHEMBL9027657

SCHEMBL9027657

CC(C)C[C@@H]1C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.53
MEN1 O00255 2/20 0.50
EP300 Q09472 1/20 0.49
CREBBP Q92793 1/20 0.49
IDO1 P14902 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
MAPT P10636 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TP53 P04637 1/20 0.48
GLA P06280 1/20 0.48
CYP3A4 P08684 1/20 0.48
THRB P10828 1/20 0.48
RIPK1 Q13546 1/20 0.48
HSD17B10 Q99714 1/20 0.48
LMNA P02545 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
POLB P06746 1/20 0.47
HPGD P15428 1/20 0.47

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
SCHEMBL9026551 1.00 KMT2A (0.53) KMT2AMEN1EP300CREBBPIDO1
SCHEMBL9026965 0.87 IDO1 (0.53) KMT2AMEN1IDO1L3MBTL1MAPT
SCHEMBL9026715 0.85 KMT2A (0.57) KMT2AMEN1EP300CREBBPIDO1
SCHEMBL9026879 0.85 KMT2A (0.57) KMT2AMEN1EP300CREBBPIDO1
SCHEMBL9026218 0.84 KMT2A (0.47) KMT2AMEN1EP300CREBBPIDO1
SCHEMBL9026074 0.84 KMT2A (0.47) KMT2AMEN1EP300CREBBPIDO1
SCHEMBL9026062 0.82 IDO1 (0.56) KMT2AMEN1EP300CREBBPIDO1
SCHEMBL9027171 0.82 IDO1 (0.56) KMT2AMEN1EP300CREBBPIDO1
SCHEMBL9026296 0.78 TACR3 (0.42)
SCHEMBL8862717 0.78 MAPT (0.48) MAPTHSD17B10ALDH1A1

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