SCHEMBL20898552

SCHEMBL20898552

Fc1ccccc1-c1cc(Cl)ccc1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.49
S100A4 P26447 1/20 0.48
CHRM1 P11229 6/20 0.47
GABRP O00591 1/20 0.47
GABRD O14764 1/20 0.47
GABRA1 P14867 1/20 0.47
GABRB1 P18505 1/20 0.47
GABRG2 P18507 1/20 0.47
GABRB3 P28472 1/20 0.47
GABRA5 P31644 1/20 0.47
GABRA3 P34903 1/20 0.47
GABRA2 P47869 1/20 0.47
GABRB2 P47870 1/20 0.47
GABRA4 P48169 1/20 0.47
GABRE P78334 1/20 0.47
GABRA6 Q16445 1/20 0.47
GABRG1 Q8N1C3 1/20 0.47
GABRG3 Q99928 1/20 0.47
GABRQ Q9UN88 1/20 0.47
LMNA P02545 1/20 0.46

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
SCHEMBL31067119 1.00 HSD11B1 (0.49) HSD11B1S100A4CHRM1GABRPGABRD
SCHEMBL20898069 0.88 HSD11B1 (0.51) HSD11B1S100A4CHRM1GABRPGABRD
SCHEMBL31067088 0.88 HSD11B1 (0.51) HSD11B1S100A4CHRM1GABRPGABRD
SCHEMBL5927386 0.86 KCNMA1 (0.46) HSD11B1S100A4CHRM1GABRPGABRD
SCHEMBL11637227 0.85 HSD11B1 (0.61) HSD11B1S100A4CHRM1GABRPGABRD
SCHEMBL23693567 0.83 HSD11B1 (0.47) HSD11B1S100A4CHRM1GABRPGABRD
SCHEMBL8816011 0.83 HSD11B1 (0.47) HSD11B1S100A4CHRM1GABRPGABRD
SCHEMBL29886972 0.83 HSD11B1 (0.47) HSD11B1S100A4CHRM1GABRPGABRD
SCHEMBL16121126 0.81 HSD11B1 (0.50) HSD11B1S100A4GABRPGABRDGABRA1
SCHEMBL2448929 0.81 TDP1 (0.48) HSD11B1S100A4CHRM1GABRPGABRD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3694849-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-08-19 EP disclosed
WO-2019073077-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-04-18 WO disclosed
WO-2019073077-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-04-18 WO disclosed