SCHEMBL9230727

SCHEMBL9230727

O=C(NN=c1c(=O)c2cccc(F)c2c1=O)Nc1ccncc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
HTT P42858 3/20 0.47
JAK2 O60674 2/20 0.47
JAK1 P23458 2/20 0.47
TYK2 P29597 2/20 0.47
NOD2 Q9HC29 1/20 0.47
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
TAAR1 Q96RJ0 2/20 0.43
BCHE P06276 2/20 0.43
MDM2 Q00987 1/20 0.43
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
PKM P14618 1/20 0.39
DNMT3B Q9UBC3 1/20 0.39
HPGD P15428 1/20 0.39

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 0.90 KMT2A (0.48) CASP3SENP8SENP7SENP6HTT
SCHEMBL8663571 0.89 RAB9A (0.45) CASP3SENP8SENP7SENP6HTT
SCHEMBL8667225 0.89 LMNA (0.49) CASP3SENP8SENP7SENP6HTT
SCHEMBL9004758 0.84 SENP6 (0.67) CASP3SENP8SENP7SENP6HTT
SCHEMBL9231193 0.81 SMN1; SMN2 (0.47) CASP3SENP8SENP7SENP6HTT
SCHEMBL9232985 0.78 KMT2A (0.52) CASP3SENP8SENP7SENP6HTT
SCHEMBL9004670 0.75 MAPT (0.55) CASP3SENP8SENP7SENP6HTT
SCHEMBL9004777 0.75 KMT2A (0.51) CASP3SENP8SENP7SENP6HTT
SCHEMBL8667830 0.74 SENP6 (0.61) CASP3SENP8SENP7SENP6KMT2A
SCHEMBL9240114 0.73 CASP3 (0.56) CASP3SENP8SENP7SENP6HTT

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

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