SCHEMBL11829751

SCHEMBL11829751

CCC(=CCO)c1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
NR4A1 P22736 1/20 0.43
NR4A2 P43354 1/20 0.43
NR4A3 Q92570 1/20 0.43
PTPN1 P18031 1/20 0.42
PLK1 P53350 1/20 0.42
CDC25B P30305 2/20 0.42
ALDH1A1 P00352 3/20 0.41
MAPT P10636 3/20 0.41
HPGD P15428 3/20 0.41
KDM4E B2RXH2 2/20 0.41
GMNN O75496 2/20 0.41
LMNA P02545 2/20 0.41
POLB P06746 2/20 0.41
MAPK1 P28482 2/20 0.41
BLM P54132 2/20 0.41
PMP22 Q01453 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
CMKLR1 Q99788 2/20 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
SCHEMBL11829747 1.00 MEN1 (0.43) MEN1KMT2ANR4A1NR4A2NR4A3
SCHEMBL27912799 0.85 PTPN1 (0.49) MEN1KMT2ANR4A1NR4A2NR4A3
SCHEMBL6027902 0.84 NR4A1 (0.47) MEN1KMT2ANR4A1NR4A2NR4A3
SCHEMBL6027903 0.84 NR4A1 (0.47) MEN1KMT2ANR4A1NR4A2NR4A3
SCHEMBL27912808 0.79 PTPN1 (0.46) MEN1KMT2ANR4A1NR4A2NR4A3
SCHEMBL6438269 0.74 MEN1 (0.45) MEN1KMT2ANR4A1NR4A2NR4A3
SCHEMBL6438266 0.74 MEN1 (0.45) MEN1KMT2ANR4A1NR4A2NR4A3
SCHEMBL6438261 0.74 MEN1 (0.45) MEN1KMT2ANR4A1NR4A2NR4A3
SCHEMBL3246864 0.74 NR4A1 (0.52) MEN1KMT2ANR4A1NR4A2NR4A3
SCHEMBL4814494 0.74 NR4A1 (0.52) MEN1KMT2ANR4A1NR4A2NR4A3

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-3995054-A MITICIDES ZOECON CORPORATION (US) 1976-11-30 US disclosed