SCHEMBL3684089

SCHEMBL3684089

Oc1ccc(C2(c3ccc(O)cc3)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C2(F)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.42
ALDH1A1 P00352 2/20 0.42
CA3 P07451 2/20 0.42
CYP3A4 P08684 2/20 0.42
HIF1A Q16665 2/20 0.42
HSD17B10 Q99714 2/20 0.42
CA14 Q9ULX7 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
CA12 O43570 1/20 0.42
GMNN O75496 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
TYR P14679 1/20 0.42
HPGD P15428 1/20 0.42
NFKB1 P19838 1/20 0.42

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
SCHEMBL10554150 1.00 ALOX15 (0.42) ALOX15ALDH1A1CA3CYP3A4HIF1A
SCHEMBL3681181 1.00 ALOX15 (0.42) ALOX15ALDH1A1CA3CYP3A4HIF1A
SCHEMBL3685814 1.00 ALOX15 (0.42) ALOX15ALDH1A1CA3CYP3A4HIF1A
SCHEMBL9848308 0.91 CA12 (0.42) ALOX15ALDH1A1CA3CYP3A4HIF1A
SCHEMBL9340069 0.84 ESR1 (0.34) ALOX15ALDH1A1CA3CYP3A4HIF1A
SCHEMBL9617031 0.74 CYP2A6 (0.42) ALOX15ALDH1A1
SCHEMBL9848309 0.74 MAOB (0.46) ALDH1A1CA1CA2MAPTCA9
SCHEMBL9848304 0.72 MAOB (0.42)
SCHEMBL18053105 0.70 ALOX15 (0.38) ALOX15ALDH1A1CA3CYP3A4HIF1A
SCHEMBL9848303 0.69 ALDH1A1 (0.42) ALOX15ALDH1A1CYP3A4HIF1AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7700714-B2 Optical element and achromatic lens TEIJIN CHEMICALS, LTD. (JP) 2010-04-20 US disclosed
US-20090143560-A1 Optical Element and Achromatic Lens TEIJIN CHEMICALS, LTD. 2009-06-04 US disclosed
EP-1947131-A1 OPTICAL DEVICE AND ACHROMATIC LENS Teijin Chemicals, Ltd. (JP) 2008-07-23 EP disclosed