SCHEMBL9004597

SCHEMBL9004597

NC(=O)NN=c1c(=O)c2ccccc2c1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.64
ALDH1A1 P00352 5/20 0.64
SENP6 Q9GZR1 3/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
KMT2A Q03164 3/20 0.64
CASP3 P42574 2/20 0.64
SENP8 Q96LD8 2/20 0.64
SENP7 Q9BQF6 2/20 0.64
APAF1 O14727 1/20 0.64
TDP2 O95551 1/20 0.64
CYP1A2 P05177 1/20 0.64
CYP2D6 P10635 1/20 0.64
THRB P10828 1/20 0.64
CYP2C9 P11712 1/20 0.64
CYP2C19 P33261 1/20 0.64
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 1/20 0.46
GAA P10253 5/20 0.42

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
SCHEMBL8856482 0.85 MAPT (0.60) MAPTALDH1A1SENP6SMN1; SMN2KMT2A
SCHEMBL9004600 0.81 MAPT (0.45) MAPTALDH1A1SENP6SMN1; SMN2KMT2A
SCHEMBL9004602 0.81 MAPT (0.45) MAPTALDH1A1SENP6SMN1; SMN2KMT2A
SCHEMBL8856519 0.78 SENP6 (0.61) MAPTALDH1A1SENP6SMN1; SMN2KMT2A
SCHEMBL8856654 0.78 ALDH1A1 (1.00) MAPTALDH1A1SENP6SMN1; SMN2KMT2A
SCHEMBL8856632 0.76 KMT2A (0.77) MAPTALDH1A1SENP6SMN1; SMN2KMT2A
SCHEMBL9004643 0.76 SENP6 (0.56) MAPTALDH1A1SENP6SMN1; SMN2KMT2A
SCHEMBL9004649 0.76 SENP6 (0.56) MAPTALDH1A1SENP6SMN1; SMN2KMT2A
SCHEMBL8602196 0.75 MAPT (0.57) MAPTALDH1A1SENP6SMN1; SMN2KMT2A
SCHEMBL8667830 0.75 SENP6 (0.61) MAPTALDH1A1SENP6SMN1; SMN2KMT2A

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