SCHEMBL14944170

SCHEMBL14944170

C=Cc1ccc(OC(C)OCCOc2c(C(C)C)cccc2C(C)C)cc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA7 P36544 1/20 0.36
CHRNA4 P43681 1/20 0.36
HPGD P15428 1/20 0.30
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
RECQL P46063 1/20 0.30
KMT2A Q03164 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL9963793 0.81 CHRNB2 (0.34) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL6536644 0.81 CHRNB2 (0.49) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL685647 0.81 CHRNA7 (0.46) ALOX15CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL683275 0.80 ALDH1A1 (0.39) ALOX15TSHRMEN1KMT2AL3MBTL1
SCHEMBL685743 0.79 CHRNA7 (0.46) ALOX15TSHRCHRNB2CHRNB4CHRNA3
SCHEMBL684984 0.78 LTA4H (0.45) ALOX15CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL12054776 0.78 NPC1 (0.37) ALOX15TSHRCYP2C9
SCHEMBL5693040 0.76 CHRNB2 (0.44) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL5900997 0.75 CHRNB2 (0.43) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL7941374 0.75 CHRNB2 (0.40) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4

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
EP-2278399-B1 Positive-working resist composition FUJIFILM CORP (JP) 2013-05-15 EP disclosed