SCHEMBL13680426

SCHEMBL13680426

O=C(/C=C/c1ccc(-c2ccc(/C=C/C(=O)c3ccccc3)cc2)cc1)c1ccccc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1B1 Q16678 6/20 0.81
MAPT P10636 5/20 0.81
MAOB P27338 4/20 0.81
BCHE P06276 3/20 0.81
LMNA P02545 2/20 0.81
PLIN1 O60240 1/20 0.81
TNFRSF1A P19438 1/20 0.81
ACHE P22303 1/20 0.81
RECQL P46063 1/20 0.81
PLIN5 Q00G26 1/20 0.81
ABHD5 Q8WTS1 1/20 0.81
CYP3A4 P08684 4/20 0.76
KMT2A Q03164 3/20 0.76
NFKB1 P19838 2/20 0.76
NFKB2 Q00653 2/20 0.76
RELA Q04206 2/20 0.76
HSPD1 P10809 2/20 0.76
HSPE1 P61604 2/20 0.76
RAB9A P51151 2/20 0.76
PKM P14618 1/20 0.76

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
SCHEMBL657749 0.98 MAPT (0.78) CYP1B1MAPTMAOBBCHELMNA
SCHEMBL657748 0.98 MAPT (0.78) CYP1B1MAPTMAOBBCHELMNA
SCHEMBL12306205 0.94 CYP1B1 (0.71) CYP1B1MAPTMAOBBCHELMNA
SCHEMBL976912 0.94 CYP1B1 (0.71) CYP1B1MAPTMAOBBCHELMNA
SCHEMBL8431772 0.94 CYP1B1 (0.91) CYP1B1MAPTMAOBBCHELMNA
SCHEMBL9915665 0.94 CYP1B1 (0.91) CYP1B1MAPTMAOBBCHELMNA
SCHEMBL12158776 0.93 CYP3A4 (0.90) CYP1B1MAPTMAOBBCHELMNA
Chalcone SCHEMBL28027252 0.92 CYP1B1 (0.88) CYP1B1MAPTMAOBBCHELMNA
SCHEMBL7072825 0.91 CYP1B1 (0.78) CYP1B1MAPTMAOBBCHELMNA
SCHEMBL27977352 0.91 MAPT (0.90) CYP1B1MAPTMAOBBCHELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582364-B2 Utilizing phosphorescence which emits light efficiently with high luminance at low current density; flat panel displays NIPPON STEEL CHEMICAL CO., LTD. (JP) 2009-09-01 US disclosed
US-7582364-B2 Utilizing phosphorescence which emits light efficiently with high luminance at low current density; flat panel displays NIPPON STEEL CHEMICAL CO., LTD. (JP) 2009-09-01 US disclosed
US-20070012935-A1 Organic electroluminescent device NIPPON STEEL CHEMICAL CO., LTD. (JP) 2007-01-18 US disclosed
US-20070012935-A1 Organic electroluminescent device NIPPON STEEL CHEMICAL CO., LTD. (JP) 2007-01-18 US disclosed