SCHEMBL8895512

SCHEMBL8895512

CCCN(CCC)C(=O)c1ccc(OCCCOc2c(C)cc(O)cc2CC)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
PLA2G4B P0C869 2/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
EGFR P00533 1/20 0.41
ERBB2 P04626 1/20 0.41
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
MAPT P10636 2/20 0.40
MLYCD O95822 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39
HPGD P15428 1/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
RAB9A P51151 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
F2 P00734 2/20 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
SCHEMBL8894361 0.98 TP53 (0.43) POLBPLA2G4BMEN1KMT2AEGFR
SCHEMBL8894804 0.93 POLB (0.46) POLBPLA2G4BEGFRERBB2TP53
SCHEMBL8910613 0.86 MAPT (0.41) POLBPLA2G4BMEN1KMT2AMAPT
SCHEMBL8910425 0.86 MAOB (0.42) POLBPLA2G4BTP53TSHRMAPT
SCHEMBL8894757 0.84 LSS (0.41) POLBMEN1KMT2ATP53TSHR
SCHEMBL8896481 0.84 MAOB (0.45) POLBPLA2G4BTP53TSHRMAPT
SCHEMBL8896987 0.83 POLB (0.45) POLBPLA2G4BEGFRERBB2TP53
SCHEMBL8895808 0.83 KMT2A (0.43) POLBPLA2G4BMEN1KMT2ATSHR
SCHEMBL8895163 0.82 POLB (0.37) POLBPLA2G4BMEN1KMT2AEGFR
SCHEMBL8895035 0.81 POLB (0.45) POLBPLA2G4BEGFRERBB2TP53

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
WO-1997027173-A2 DIHALOPROPENE COMPOUNDS, THEIR USE AS INSECTICIDES/ACARICIDES AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-31 WO disclosed