SCHEMBL9004762

SCHEMBL9004762

COc1ccc(OC)c(NC(=O)NN=c2c(=O)c3ccccc3c2=O)c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.60
KMT2A Q03164 6/20 0.60
ALDH1A1 P00352 2/20 0.60
KDM4E B2RXH2 1/20 0.60
HPGD P15428 1/20 0.60
HSP90AA1 P07900 1/20 0.59
GAA P10253 2/20 0.57
SENP6 Q9GZR1 1/20 0.57
MAPT P10636 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
ADORA3 P0DMS8 1/20 0.52
HTT P42858 2/20 0.50
ALOX15 P16050 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
POLB P06746 1/20 0.49
TP53 P04637 1/20 0.49
RXFP1 Q9HBX9 1/20 0.48
LMNA P02545 1/20 0.48

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
SCHEMBL9004641 0.87 SENP6 (0.56) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL9004683 0.86 SENP6 (0.56) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL9004627 0.83 TSHR (0.50) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL9004693 0.81 SENP6 (0.52) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL9004703 0.81 SENP6 (0.52) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL9004613 0.81 SENP6 (0.67) MEN1KMT2AALDH1A1KDM4ESENP6
SCHEMBL9004721 0.81 SENP6 (0.60) MEN1KMT2AALDH1A1GAASENP6
SCHEMBL9004785 0.81 KMT2A (0.52) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL9004684 0.80 SENP6 (0.62) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL9004632 0.80 SENP6 (0.55) MEN1KMT2AALDH1A1GAASENP6

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5571843-A Derivatives of indan-1,3-dione and indan-1,2,3-trione, methods of preparing them and therapeutic use thereof INNOTHERA (FR) 1996-11-05 US disclosed
EP-0566445-B1 Derivatives of indane 1,3-dione and indane-1,2,3-trione, processes for their preparation and their application in therapy INNOTHERA LAB SA (FR) 1996-02-07 EP disclosed
EP-0566445-A1 Derivatives of indane 1,3-dione and indane-1,2,3-trione, processes for their preparation and their application in therapy INNOTHERA (FR) 1993-10-20 EP disclosed
WO-1993020045-A1 INDAN-1,3-DIONE AND INDAN-1,2,3-TRIONE DERIVATIVES, PROCESSES FOR THE PREPARATION OF SAME AND THEIR APPLICATION AS THERAPEUTIC AGENTS INNOTHERA (FR) 1993-10-14 WO disclosed