SCHEMBL780794

SCHEMBL780794

C(=C(c1ccccc1)c1cccc2c1Cc1ccccc1-2)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.45
HTR2B P41595 1/20 0.45
ESR1 P03372 1/20 0.40
HSP90AA1 P07900 2/20 0.40
PNMT P11086 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP19A1 P11511 2/20 0.39
CYP11B2 P19099 2/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37
DRD3 P35462 1/20 0.37
MIF P14174 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
SRD5A2 P31213 1/20 0.36
ATM Q13315 1/20 0.35
PTGS2 P35354 1/20 0.35

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
SCHEMBL28383222 0.78 HTR7 (0.50) HTR7HTR2BHSP90AA1PNMTMEN1
SCHEMBL5945849 0.77 ESR1 (0.53) ESR1MEN1KMT2ACYP19A1CYP11B2
SCHEMBL4612464 0.75 ESR1 (0.59) ESR1MEN1KMT2ACYP19A1CYP11B2
SCHEMBL4612461 0.75 ESR1 (0.59) ESR1MEN1KMT2ACYP19A1CYP11B2
SCHEMBL5820630 0.73 HTR2B (0.57) HTR7HTR2BHSP90AA1PNMTNPC1
SCHEMBL828195 0.73 ESR1 (0.48) ESR1MEN1KMT2ACYP19A1CYP11B2
SCHEMBL828193 0.73 ESR1 (0.48) ESR1MEN1KMT2ACYP19A1CYP11B2
SCHEMBL29638295 0.73 HSP90AA1 (0.67) HTR7HTR2BHSP90AA1PNMTNPC1
SCHEMBL31229252 0.73 HSP90AA1 (0.67) HTR7HTR2BHSP90AA1PNMTNPC1
SCHEMBL67699 0.73 HSP90AA1 (0.67) HTR7HTR2BHSP90AA1PNMTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8389985-B2 Color conversion film containing a conjugated high molecular weight copolymer and multicolor light-emitting organic EL device including the same SHARP KABUSHIKI KAISHA (JP) 2013-03-05 US disclosed
US-20120068163-A1 COLOR CONVERSION FILM CONTAINING A CONJUGATED HIGH MOLECULAR WEIGHT COPOLYMER AND MULTICOLOR LIGHT-EMITTING ORGANIC EL DEVICE INCLUDING THE SAME FUJI ELECTRIC HOLDINGS CO., LTD. (JP) 2012-03-22 US disclosed