SCHEMBL6913018

SCHEMBL6913018

O=CCc1c(F)cccc1Oc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
GAA P10253 1/20 0.47
KMT2A Q03164 1/20 0.47
TSHR P16473 1/20 0.44
DPP4 P27487 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
SLC6A4 P31645 2/20 0.42
HTR1A P08908 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A3 Q01959 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HRH1 P35367 1/20 0.41
PARP10 Q53GL7 1/20 0.41
FAAH O00519 1/20 0.39
HTT P42858 1/20 0.38
HTR2A P28223 1/20 0.38
CTNNB1 P35222 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL18094957 0.83 DPP4 (0.42) LMNAGAAKMT2ATSHRDPP4
SCHEMBL1957643 0.79 NFE2L2 (0.43) LMNAKMT2AL3MBTL1SLC6A4SLC6A2
SCHEMBL1459660 0.78 ERN1 (0.40) GAAKMT2ATDP1HTT
SCHEMBL1466243 0.78 CTNNB1 (0.50) LMNAGAAKMT2ATSHRL3MBTL1
SCHEMBL1764909 0.76 LMNA (0.55) LMNAGAAKMT2ATSHRL3MBTL1
SCHEMBL6908530 0.75 LMNA (0.42) LMNAGAAKMT2ATSHRSLC6A4
SCHEMBL7198129 0.75 HTR1A (0.41) LMNAGAAKMT2ATSHRL3MBTL1
SCHEMBL872937 0.75 HRH1 (0.55) LMNAGAAKMT2ATSHRSLC6A4
SCHEMBL16148965 0.75 KMT2A (0.46) LMNAGAAKMT2ATSHRL3MBTL1
SCHEMBL6913020 0.74 SLC6A4 (0.49) LMNAGAAKMT2ATSHRSLC6A4

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-6770463-B2 INSECTICIDES AND ACARICIDES; AROMATIC SUBSTITUTED HALOALKENES BASF AKTIENGESELLSCHAFT (DE) 2004-08-03 US disclosed