SCHEMBL9999646

SCHEMBL9999646

Cc1cccc2c(OS(=O)(=O)C(F)(F)F)cccc12

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
ESR1 P03372 3/20 0.49
KMT2A Q03164 3/20 0.49
ESR2 Q92731 3/20 0.49
GAA P10253 2/20 0.49
CYP1A2 P05177 1/20 0.43
CYP2A6 P11509 1/20 0.43
DRD2 P14416 10/20 0.41
DRD3 P35462 7/20 0.41
DRD4 P21917 5/20 0.41
DRD1 P21728 3/20 0.41
DRD5 P21918 3/20 0.41
HTR5A P47898 1/20 0.40
HTR1D P28221 2/20 0.38

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
SCHEMBL6938489 0.90 CYP1A2 (0.43) MEN1ESR1KMT2AESR2GAA
SCHEMBL203899 0.89 MEN1 (0.42) MEN1ESR1KMT2AESR2GAA
SCHEMBL29706003 0.89 MEN1 (0.42) MEN1ESR1KMT2AESR2GAA
SCHEMBL12476299 0.85 MEN1 (0.41) MEN1ESR1KMT2AESR2GAA
SCHEMBL15307384 0.85 MEN1 (0.41) MEN1ESR1KMT2AESR2GAA
SCHEMBL6934553 0.83 MAPT (0.43) MEN1ESR1KMT2AESR2GAA
SCHEMBL2984151 0.82 DRD2 (0.42) MEN1ESR1KMT2AESR2GAA
SCHEMBL30665126 0.82 DRD2 (0.42) MEN1ESR1KMT2AESR2GAA
SCHEMBL6851155 0.82 MEN1 (0.38) MEN1ESR1KMT2AESR2GAA
SCHEMBL3222252 0.81 ESR1 (0.55) MEN1ESR1KMT2AESR2GAA

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-20150357575-A1 AMINE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-12-10 US disclosed
US-9147843-B2 Organic semiconductor material SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-09-29 US disclosed
US-20150065671-A1 ORGANIC SEMICONDUCTOR MATERIAL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-03-05 US disclosed
WO-2012011510-A1 ORGANIC EL ELEMENT 住友化学株式会社 (JP) 2012-01-26 WO disclosed