SCHEMBL6478736

SCHEMBL6478736

C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2cc(N(c3ccccc3)c3ccccc3)ccc2Nc2ccccc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.35
CYP11B2 P19099 2/20 0.35
PTGS2 P35354 5/20 0.35
ESR1 P03372 1/20 0.33
EGFR P00533 2/20 0.32
SRC P12931 2/20 0.32
ALDH1A1 P00352 4/20 0.32
MAPT P10636 4/20 0.32
KDM4E B2RXH2 3/20 0.32
HPGD P15428 3/20 0.32
GAA P10253 1/20 0.32
THRB P10828 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPK1 P28482 3/20 0.31
MEN1 O00255 2/20 0.31
LMNA P02545 2/20 0.31
KMT2A Q03164 2/20 0.31
RGS12 O14924 1/20 0.31
GMNN O75496 1/20 0.31
PRKD3 O94806 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
SCHEMBL7689154 0.83 PTGS2 (0.30) PTGS2
SCHEMBL2214749 0.81 KDM1A (0.33) ALDH1A1MAPTKDM4EHPGDCYP2D6
SCHEMBL6033523 0.79 MAPT (0.46) EGFRSRCALDH1A1MAPTKDM4E
SCHEMBL9971850 0.79 CYP19A1 (0.50) CYP19A1CYP11B2PTGS2ESR1ALDH1A1
SCHEMBL14018372 0.79 CYP19A1 (0.50) CYP19A1CYP11B2PTGS2ESR1ALDH1A1
SCHEMBL6140178 0.79 CYP19A1 (0.50) CYP19A1CYP11B2PTGS2ESR1ALDH1A1
SCHEMBL2328313 0.79 CYP19A1 (0.50) CYP19A1CYP11B2PTGS2ESR1ALDH1A1
SCHEMBL14018344 0.79 CYP19A1 (0.50) CYP19A1CYP11B2PTGS2ESR1ALDH1A1
SCHEMBL14018342 0.79 CYP19A1 (0.50) CYP19A1CYP11B2PTGS2ESR1ALDH1A1
SCHEMBL6140079 0.79 CYP19A1 (0.50) CYP19A1CYP11B2PTGS2ESR1ALDH1A1

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-20050194586-A1 Luminous element and method for preparation thereof JOLED INC (JP) 2005-09-08 US disclosed