SCHEMBL9617201

SCHEMBL9617201

C(=C(c1ccc2ccccc2n1)N(c1ccccc1)c1ccccc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.54
KDM4E B2RXH2 7/20 0.54
MEN1 O00255 7/20 0.54
KMT2A Q03164 7/20 0.54
ALDH1A1 P00352 7/20 0.54
HPGD P15428 2/20 0.54
MGAM O43451 1/20 0.47
SMN1; SMN2 Q16637 5/20 0.45
GAA P10253 5/20 0.45
CNR2 P34972 2/20 0.44
LMNA P02545 4/20 0.43
RAB9A P51151 5/20 0.42
NPC1 O15118 2/20 0.42
RECQL P46063 1/20 0.41
PKM P14618 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
PDE10A Q9Y233 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
SCHEMBL8822084 0.90 MAPT (0.48) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL1348645 0.83 LMNA (0.55) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL8822056 0.81 ALDH1A1 (0.43) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL2494588 0.79 MEN1 (0.51) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL8520463 0.77 KDM4E (0.49) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL15549323 0.77 MAPT (0.62) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL19591528 0.74 MAPT (0.59) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL11400893 0.72 MAPT (0.60) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL9446234 0.71 TRPM8 (0.48) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL6031703 0.71 TRPM8 (0.48) MAPTKDM4EMEN1KMT2AALDH1A1

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
JP-4018074-A None JP disclosed
JP-H0418074-A TRIPHENYLAMINE DERIVATIVE HITACHI LTD 1992-01-22 JP disclosed