SCHEMBL8856817

SCHEMBL8856817

COc1cccc(C(=O)NN=c2c(=O)c3ccc(OC)cc3c2=O)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SENP6 Q9GZR1 3/20 0.67
SMN1; SMN2 Q16637 4/20 0.55
ALDH1A1 P00352 3/20 0.55
KMT2A Q03164 2/20 0.55
CASP3 P42574 2/20 0.55
SENP8 Q96LD8 2/20 0.55
SENP7 Q9BQF6 2/20 0.55
APAF1 O14727 1/20 0.55
TDP2 O95551 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2D6 P10635 1/20 0.55
MAPT P10636 1/20 0.55
THRB P10828 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
NPC1 O15118 6/20 0.50
RAB9A P51151 6/20 0.50
RXFP1 Q9HBX9 1/20 0.49
MEN1 O00255 1/20 0.49
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
SCHEMBL8856811 1.00 SENP6 (0.67) SENP6SMN1; SMN2ALDH1A1KMT2ACASP3
SCHEMBL8856672 0.92 SENP6 (0.74) SENP6SMN1; SMN2ALDH1A1KMT2ACASP3
SCHEMBL8856764 0.92 SENP6 (0.62) SENP6SMN1; SMN2ALDH1A1KMT2ACASP3
SCHEMBL8856769 0.92 SENP6 (0.62) SENP6SMN1; SMN2ALDH1A1KMT2ACASP3
SCHEMBL8856663 0.91 SENP6 (0.76) SENP6SMN1; SMN2ALDH1A1KMT2ACASP3
SCHEMBL8856659 0.91 SENP6 (0.76) SENP6SMN1; SMN2ALDH1A1KMT2ACASP3
SCHEMBL8856608 0.84 SENP6 (0.66) SENP6SMN1; SMN2ALDH1A1KMT2ACASP3
SCHEMBL8856612 0.84 SENP6 (0.66) SENP6SMN1; SMN2ALDH1A1KMT2ACASP3
SCHEMBL8856704 0.81 SENP6 (0.57) SENP6SMN1; SMN2ALDH1A1KMT2ACASP3
SCHEMBL8856707 0.81 SENP6 (0.57) SENP6SMN1; SMN2ALDH1A1KMT2ACASP3

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