SCHEMBL11463568

SCHEMBL11463568

Brc1ccc(Nc2nc3ccccc3n3ccnc23)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.58
KMT2A Q03164 3/20 0.58
HPGD P15428 2/20 0.58
MEN1 O00255 2/20 0.58
NPSR1 Q6W5P4 1/20 0.58
MAPK8 P45983 7/20 0.56
SMN1; SMN2 Q16637 2/20 0.51
LMNA P02545 1/20 0.51
MAPK1 P28482 1/20 0.51
HSD17B10 Q99714 1/20 0.51
GAA P10253 1/20 0.50
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 1/20 0.47
LCK P06239 1/20 0.45
ATM Q13315 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
HTR3E A5X5Y0 1/20 0.44

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
SCHEMBL11480484 0.89 MAPK8 (0.65) MAPTKMT2AHPGDMEN1MAPK8
SCHEMBL11471226 0.87 KDM4E (0.58) MAPTKMT2AHPGDMEN1MAPK8
SCHEMBL11465002 0.87 TNKS (0.58) MAPTKMT2AHPGDMEN1MAPK8
SCHEMBL11411479 0.87 MAPT (0.58) MAPTKMT2AHPGDMEN1MAPK8
SCHEMBL11461259 0.87 MAPK8 (0.56) MAPTKMT2AHPGDMEN1NPSR1
SCHEMBL11460081 0.84 MAPK8 (0.59) MAPTKMT2AHPGDMAPK8SMN1; SMN2
SCHEMBL11462148 0.81 KMT2A (0.56) MAPTKMT2AHPGDMEN1MAPK8
SCHEMBL11463548 0.81 KMT2A (0.69) MAPTKMT2AHPGDMEN1MAPK8
SCHEMBL11467626 0.79 KMT2A (0.61) MAPTKMT2AHPGDMEN1MAPK8
SCHEMBL11463389 0.78 KMT2A (0.71) MAPTKMT2AMEN1MAPK8LCK

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
US-4197403-A ANTIINFLAMMATORY, IMMUNOSUPPRESSIVE, FUNGICIDE WESTWOOD PHARMACEUTICALS INC. (US) 1980-04-08 US claimed