SCHEMBL8856519

SCHEMBL8856519

COC(=O)NN=c1c(=O)c2ccccc2c1=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SENP6 Q9GZR1 3/20 0.61
MAPT P10636 5/20 0.60
SMN1; SMN2 Q16637 5/20 0.60
ALDH1A1 P00352 4/20 0.60
CASP3 P42574 2/20 0.60
SENP8 Q96LD8 2/20 0.60
SENP7 Q9BQF6 2/20 0.60
KMT2A Q03164 2/20 0.60
APAF1 O14727 1/20 0.60
TDP2 O95551 1/20 0.60
CYP1A2 P05177 1/20 0.60
CYP2D6 P10635 1/20 0.60
THRB P10828 1/20 0.60
CYP2C9 P11712 1/20 0.60
CYP2C19 P33261 1/20 0.60
PKM P14618 1/20 0.51
CASP6 P55212 1/20 0.51
PTGES O14684 1/20 0.46
PTGS2 P35354 1/20 0.46
NPC1 O15118 4/20 0.45

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
SCHEMBL8666110 0.83 KMT2A (0.54) SENP6MAPTSMN1; SMN2ALDH1A1CASP3
SCHEMBL8856704 0.81 SENP6 (0.57) SENP6MAPTSMN1; SMN2ALDH1A1CASP3
SCHEMBL8856707 0.81 SENP6 (0.57) SENP6MAPTSMN1; SMN2ALDH1A1CASP3
SCHEMBL9004597 0.78 MAPT (0.64) SENP6MAPTSMN1; SMN2ALDH1A1CASP3
SCHEMBL8856794 0.77 SENP6 (1.00) SENP6MAPTSMN1; SMN2ALDH1A1CASP3
SCHEMBL8856587 0.77 SENP6 (0.67) SENP6MAPTSMN1; SMN2ALDH1A1CASP3
SCHEMBL8856654 0.75 ALDH1A1 (1.00) SENP6MAPTSMN1; SMN2ALDH1A1CASP3
SCHEMBL8856482 0.75 MAPT (0.60) SENP6MAPTSMN1; SMN2ALDH1A1CASP3
SCHEMBL9004607 0.75 MAPT (0.55) SENP6MAPTSMN1; SMN2ALDH1A1CASP3
SCHEMBL9004683 0.75 SENP6 (0.56) SENP6MAPTSMN1; SMN2ALDH1A1CASP3

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-5648381-A Derivatives of indan-1,3-dione and indan-1,2,3-trione, methods of preparing them and therapeutic use thereof INNOTHERA (FR) 1997-07-15 US disclosed
EP-0566446-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-0566446-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-1993020046-A1 INDAN-1,3-DIONE AND INDAN-1,2,3-TRIONE DERIVATIVES, PROCESSES FOR PREPARATION OF SAME AND THEIR USE AS THERAPEUTIC AGENTS INNOTHERA (FR) 1993-10-14 WO disclosed