SCHEMBL11089081

SCHEMBL11089081

CCOc1ccccc1Nc1cnc2c(cnn2-c2ccccc2)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.59
LMNA P02545 1/20 0.59
TSHR P16473 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
TP53 P04637 3/20 0.46
MAPK10 P53779 1/20 0.46
GAA P10253 3/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
ALDH1A1 P00352 3/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HSD17B10 Q99714 3/20 0.43
KDM4E B2RXH2 2/20 0.43
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
HPGD P15428 3/20 0.41
P2RX7 Q99572 1/20 0.41
RXFP1 Q9HBX9 1/20 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
SCHEMBL11090022 0.88 MAPT (0.47) MAPTLMNATSHRNPSR1TP53
SCHEMBL11087146 0.83 MAPT (0.60) MAPTLMNATSHRNPSR1TP53
SCHEMBL11089591 0.82 MAPT (0.47) MAPTLMNATSHRNPSR1GAA
SCHEMBL11091891 0.82 LMNA (0.55) MAPTLMNATSHRTP53MAPK10
SCHEMBL11084694 0.79 TP53 (0.51) MAPTLMNATSHRNPSR1TP53
SCHEMBL11090510 0.79 PDGFRB (0.55) MAPTLMNATSHRNPSR1TP53
SCHEMBL11091998 0.77 LMNA (0.49) MAPTLMNATSHRNPSR1TP53
SCHEMBL11087676 0.77 MAPT (0.59) MAPTLMNATSHRTP53MAPK10
SCHEMBL11130485 0.77 KDM4E (0.47) MAPTLMNATSHRNPSR1TP53
SCHEMBL11091553 0.76 MAPT (0.49) MAPTLMNANPSR1TP53SMN1; SMN2

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-4460773-A ANTITUMOR AGENTS, VIRICIDES LION CORPORATION (JP) 1984-07-17 US disclosed