SCHEMBL8663571

SCHEMBL8663571

O=C(NN=c1c(=O)c2cccc(F)c2c1=O)Nc1ccc(F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.45
NPC1 O15118 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
POLB P06746 2/20 0.45
HTT P42858 2/20 0.45
KMT2A Q03164 6/20 0.42
MAPT P10636 4/20 0.42
SENP6 Q9GZR1 3/20 0.42
CASP3 P42574 2/20 0.42
SENP8 Q96LD8 2/20 0.42
SENP7 Q9BQF6 2/20 0.42
APAF1 O14727 1/20 0.42
TDP2 O95551 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
THRB P10828 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
MEN1 O00255 4/20 0.41

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
SCHEMBL8664293 0.91 KMT2A (0.48) RAB9ANPC1SMN1; SMN2POLBHTT
SCHEMBL9230727 0.89 CASP3 (0.49) RAB9ASMN1; SMN2HTTKMT2AMAPT
SCHEMBL9004670 0.87 MAPT (0.55) RAB9ANPC1SMN1; SMN2POLBHTT
SCHEMBL8667225 0.82 LMNA (0.49) RAB9ANPC1SMN1; SMN2HTTKMT2A
SCHEMBL9004777 0.76 KMT2A (0.51) RAB9ANPC1SMN1; SMN2POLBHTT
SCHEMBL9004624 0.75 RAB9A (0.50) RAB9ANPC1SMN1; SMN2POLBKMT2A
SCHEMBL8667830 0.75 SENP6 (0.61) RAB9ANPC1SMN1; SMN2POLBKMT2A
SCHEMBL8664300 0.74 SMN1; SMN2 (0.50) RAB9ANPC1SMN1; SMN2POLBHTT
SCHEMBL9004724 0.74 EPHX2 (0.57) RAB9ANPC1SMN1; SMN2HTTKMT2A
SCHEMBL9004678 0.73 SMN1; SMN2 (0.51) RAB9ANPC1SMN1; SMN2KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0646574-B1 Ketonic indane derivatives, their preparation and therapeutic application thereof INNOTHERA LAB SA (FR) 1998-12-09 EP disclosed
EP-0646574-A1 Ketonic indane derivatives, their preparation and therapeutic application thereof LABORATOIRE INNOTHERA Société Anonyme (FR) 1995-04-05 EP disclosed