SCHEMBL11027181

SCHEMBL11027181

Nc1ccc(N2CCC=N2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.42
MAPT P10636 9/20 0.41
ALDH1A1 P00352 6/20 0.41
KDM4E B2RXH2 4/20 0.41
KMT2A Q03164 4/20 0.41
GAA P10253 3/20 0.41
MEN1 O00255 3/20 0.41
HTT P42858 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
RECQL P46063 2/20 0.41
NPC1 O15118 1/20 0.41
USP2 O75604 1/20 0.41
POLB P06746 1/20 0.41
THRB P10828 1/20 0.41
ALOX15 P16050 1/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GFER P55789 4/20 0.39
LMNA P02545 4/20 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
SCHEMBL11401374 0.89 TP53 (0.47) TP53ACHE
SCHEMBL9244639 0.88 MAPT (0.42) TP53MAPTALDH1A1KDM4EKMT2A
SCHEMBL8942576 0.79 TP53 (0.46) TP53MAPTALDH1A1KDM4EKMT2A
SCHEMBL980136 0.79 TP53 (0.42) TP53
SCHEMBL27291390 0.79 TP53 (0.42) TP53MAPTALDH1A1KDM4EKMT2A
SCHEMBL6304342 0.78 TP53 (0.48) TP53MAPTKDM4EKMT2AMEN1
SCHEMBL10655726 0.77 ADRA2C (0.47) TP53MAPTALDH1A1KDM4EKMT2A
SCHEMBL27762333 0.76 TP53 (0.47) TP53MAPTALDH1A1KDM4EKMT2A
SCHEMBL14387532 0.75 TP53 (0.43) TP53MAPTALDH1A1KDM4EKMT2A
SCHEMBL17915946 0.75 TP53 (0.43) TP53MAPTALDH1A1KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105037712-B Organic blue-fluorescent material and preparation method thereof 内江师范学院 2017-05-10 CN claimed
CN-105037712-B Organic blue-fluorescent material and preparation method thereof 内江师范学院 2017-05-10 CN disclosed
EP-0048834-B1 METHOD FOR MEASUREMENT OF TRACE ENZYMES FUJI PHOTO FILM CO., LTD. (JP) 1985-06-19 EP disclosed
US-4414325-A PHOTOGRAPHY FUJI PHOTO FILM CO., LTD. (JP) 1983-11-08 US disclosed
EP-0048834-A1 Method for measurement of trace enzymes FUJI PHOTO FILM CO., LTD. (JP) 1982-04-07 EP disclosed