SCHEMBL16601851

SCHEMBL16601851

Cc1cc2c(cc1O)C(C)(C)CC1(CC(C)(C)c3cc(O)c(O)cc3O1)O2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 2/20 0.46
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
G6PD P11413 1/20 0.31
CYP2C9 P11712 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31

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
SCHEMBL12997667 0.97 FTO (0.46) FTOMAPTMEN1LMNAPOLB
SCHEMBL3615121 0.97 FTO (0.44) FTOMAPTMEN1LMNAPOLB
SCHEMBL30471544 0.97 FTO (0.44) FTOMAPTMEN1LMNAPOLB
SCHEMBL13607193 0.93 FTO (0.48) FTOMAPTMEN1LMNAPOLB
SCHEMBL31232341 0.92 FTO (0.51) FTOALDH1A1
SCHEMBL2548277 0.92 FTO (0.51) FTOALDH1A1
SCHEMBL12171006 0.84 FTO (0.36) FTOMAPTMEN1LMNAPOLB
SCHEMBL7523777 0.83 FTO (0.38) FTO
SCHEMBL12352180 0.81 FTO (0.65) FTOMAPTMEN1LMNAPOLB
SCHEMBL3624354 0.80 FTO (0.34) FTO

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-8994016-B2 Dielectric layer for an electronic device XEROX CORPORATION (US) 2015-03-31 US disclosed