SCHEMBL14902890

SCHEMBL14902890

COc1ccc(C2(c3ccccc3F)C=Cc3c(ccc4cc(C)ccc34)O2)cc1

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
THRB P10828 2/20 0.32
HPGD P15428 2/20 0.32
HTT P42858 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
ALOX12 P18054 1/20 0.32
POLB P06746 1/20 0.32
MAPK1 P28482 1/20 0.32
RECQL P46063 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
DPP4 P27487 4/20 0.32
HIF1A Q16665 1/20 0.31
SIRT2 Q8IXJ6 2/20 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
SCHEMBL7122482 0.94 DPP4 (0.35) KDM4EALDH1A1MAPTTHRBHPGD
SCHEMBL3926851 0.93 DPP4 (0.36) KDM4EALDH1A1MAPTTHRBHPGD
SCHEMBL2400659 0.89 KDM4E (0.38) KDM4EALDH1A1MAPTTHRBHPGD
Benzene SCHEMBL7241108 0.88 LMNA (0.31) KDM4EALDH1A1MAPTTHRBHPGD
SCHEMBL13677583 0.85 HIF1A (0.34) KDM4EALDH1A1MAPTTHRBHPGD
SCHEMBL13677565 0.85 DPP4 (0.33) KDM4EALDH1A1MAPTTHRBHPGD
SCHEMBL5097862 0.83 KDM4E (0.40) KDM4EALDH1A1MAPTTHRBHPGD
SCHEMBL7241102 0.83 GRM2 (0.34) ALDH1A1SMN1; SMN2L3MBTL1HIF1A
SCHEMBL7269803 0.82 MAPT (0.33) KDM4EMAPTSMN1; SMN2LMNAPOLB
SCHEMBL7126396 0.81 CYP1A2 (0.36) KDM4EALDH1A1MAPTTHRBHPGD

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-20130108858-A1 Methods for Making an Article Coated with a Photochromic Film and Use Thereof in Ophthalmological Optics Essilor International (Compagnie Generate d Optique (FR) 2013-05-02 US disclosed