SCHEMBL9004655

SCHEMBL9004655

O=C(NN=c1c(=O)c2ccccc2c1=O)Nc1ccccc1C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.57
MEN1 O00255 4/20 0.57
KDM4E B2RXH2 2/20 0.57
POLB P06746 4/20 0.48
MAPK1 P28482 1/20 0.48
ALDH1A1 P00352 4/20 0.48
CASP3 P42574 2/20 0.48
SENP8 Q96LD8 2/20 0.48
SENP7 Q9BQF6 2/20 0.48
SENP6 Q9GZR1 2/20 0.48
MAPT P10636 2/20 0.48
THRB P10828 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
APAF1 O14727 1/20 0.48
TDP2 O95551 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
TRPV1 Q8NER1 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
SCHEMBL9004668 0.82 RAB9A (0.57) KMT2AMEN1KDM4EPOLBALDH1A1
SCHEMBL9004741 0.80 MAPT (0.53) KMT2AMEN1KDM4EPOLBALDH1A1
SCHEMBL9004724 0.80 EPHX2 (0.57) KMT2AMEN1ALDH1A1CASP3SENP8
SCHEMBL9004618 0.79 KMT2A (0.63) KMT2AMEN1KDM4EPOLBMAPK1
SCHEMBL9232385 0.79 SENP6 (0.51) KMT2AMEN1MAPK1ALDH1A1CASP3
SCHEMBL9004654 0.79 KMT2A (0.51) KMT2AMEN1ALDH1A1CASP3SENP8
SCHEMBL9004650 0.79 MAPT (0.51) KMT2AMEN1KDM4EPOLBALDH1A1
SCHEMBL9004683 0.76 SENP6 (0.56) KMT2AMEN1KDM4EPOLBALDH1A1
SCHEMBL9004595 0.75 MAPT (0.60) KMT2AMEN1KDM4EALDH1A1MAPT
SCHEMBL8667830 0.75 SENP6 (0.61) KMT2AMEN1KDM4EPOLBALDH1A1

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