SCHEMBL27435083

SCHEMBL27435083

CC(C)CCCC(C)CCOc1ccc(O)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.47
ADRB2 P07550 1/20 0.43
FDPS P14324 2/20 0.42
GSTO1 P78417 1/20 0.40
TDP1 Q9NUW8 2/20 0.40
GGPS1 O95749 1/20 0.39
MAPK1 P28482 1/20 0.39
EGFR P00533 2/20 0.39
RARB P10826 1/20 0.38
KDM4E B2RXH2 2/20 0.38
EPHX2 P34913 1/20 0.38
PDK2 Q15119 1/20 0.36
LMNA P02545 2/20 0.35
ALDH1A1 P00352 1/20 0.35
S1PR1 P21453 1/20 0.34
S1PR5 Q9H228 1/20 0.34

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
SCHEMBL16340342 0.80 TDP1 (0.58) ALOX5FDPSGSTO1TDP1GGPS1
SCHEMBL6857008 0.80 TDP1 (0.58) ALOX5FDPSGSTO1TDP1GGPS1
SCHEMBL2050248 0.79 ALOX5 (0.55) ALOX5FDPSTDP1GGPS1MAPK1
SCHEMBL17912821 0.77 LTA4H (0.50) ADRB2TDP1KDM4EALDH1A1
SCHEMBL17286610 0.76 KDM4E (0.57) TDP1RARBKDM4ELMNAALDH1A1
SCHEMBL3720786 0.76 ADRB2 (0.45) ADRB2TDP1PDK2LMNAALDH1A1
SCHEMBL18837357 0.75 NPC1 (0.55) ALOX5GSTO1TDP1MAPK1KDM4E
SCHEMBL8408909 0.75 ALOX5 (0.39) ALOX5FDPSGSTO1TDP1GGPS1
SCHEMBL22282461 0.75 TDP1 (0.41) ALOX5FDPSGSTO1TDP1GGPS1
SCHEMBL27438432 0.75 PPARG (0.43) ADRB2TDP1KDM4ELMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1128777-C Dihalopropene compounds, insecticidal/acaricidal agents containing same, and intermediates for their production SUMITOMO CHEMICAL CO (JP) 2003-11-26 CN disclosed
CN-1137265-A Dihalopropene compounds, insecticides/acaricides containing the same and intermediates for their production SUMITOMO CHEMICAL CO (JP) 1996-12-04 CN disclosed