SCHEMBL7920903

SCHEMBL7920903

COC(O)c1ccccc1I

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.35
SLC6A4 P31645 3/20 0.35
SLC6A3 Q01959 3/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2D6 P10635 2/20 0.35
KCNH2 Q12809 1/20 0.35
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
ESR1 P03372 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
SCHEMBL18892781 0.84 GABRA1 (0.39) SLC6A2SLC6A4SLC6A3CYP3A4CYP2D6
SCHEMBL22144119 0.80
SCHEMBL20604273 0.78 MGAM (0.46) SLC6A2SLC6A4SLC6A3CYP3A4CYP2D6
SCHEMBL20604270 0.78 MGAM (0.46) SLC6A2SLC6A4SLC6A3CYP3A4CYP2D6
SCHEMBL3213376 0.77 ESR1 (0.33) SLC6A2SLC6A4SLC6A3CYP3A4CYP2D6
SCHEMBL11606150 0.76 CYP3A4 (0.44) SLC6A2SLC6A4SLC6A3CYP3A4CYP2D6
SCHEMBL1755231 0.76 ESR1 (0.52) SLC6A2SLC6A4SLC6A3CYP3A4CYP2D6
SCHEMBL467714 0.76 GABRA1 (0.54) SLC6A2CYP3A4GABRA1GABRB2
SCHEMBL6204702 0.76 GABRA1 (0.48) SLC6A2CYP3A4GABRA1GABRB2
SCHEMBL6203758 0.76 CA1 (0.52) CYP3A4CYP2D6

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
EP-2968211-A1 PHENYL ALKYL CARBAMATE COMPOUNDS FOR USE IN PREVENTING OR TREATING EPILEPSY OR EPILEPSY-RELATED SYNDROME Bio-Pharm Solutions Co., Ltd. (KR) 2016-01-20 EP claimed
WO-2014142519-A1 PHENYL ALKYL CARBAMATE COMPOUNDS FOR USE IN PREVENTING OR TREATING EPILEPSY OR EPILEPSY-RELATED SYNDROME BIO-PHARM SOLUTIONS CO., LTD. (KR) 2014-09-18 WO claimed
WO-2010076564-A2 ISOCHROMENONES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2010-07-08 WO disclosed
EP-2182040-A2 Aromatic compounds and organic electronic device using the same Gracel Display Inc. (KR) 2010-05-05 EP disclosed