SCHEMBL5573140

SCHEMBL5573140

FC(F)(N=C=S)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
TSHR P16473 2/20 0.44
MIF P14174 9/20 0.39
TRPA1 O75762 2/20 0.35
PTPN1 P18031 1/20 0.35
CYP3A4 P08684 1/20 0.35
HPGD P15428 1/20 0.35
KCNN4 O15554 3/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA5A P35218 1/20 0.34
CA9 Q16790 1/20 0.34
CYP2E1 P05181 1/20 0.33
CYP2A6 P11509 1/20 0.33
HIF1A Q16665 1/20 0.33
CYP2A13 Q16696 1/20 0.33
EPAS1 Q99814 1/20 0.33
KIF11 P52732 1/20 0.33
MEN1 O00255 2/20 0.32
MAPT P10636 2/20 0.32

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
SCHEMBL25119687 0.78 CYP19A1 (0.37) ALDH1A1TSHRMIFCYP2A6HIF1A
SCHEMBL25119933 0.78 TSHR (0.39) ALDH1A1TSHRMIFCYP3A4CA1
SCHEMBL27686357 0.77 TSHR (0.44) ALDH1A1TSHRPTPN1KCNN4CA1
(Isothiocyanatomethanetriyl)Tribenzene SCHEMBL957836 0.76 MIF (0.42) ALDH1A1TSHRMIFTRPA1CYP3A4
SCHEMBL4386996 0.76 MIF (0.42) ALDH1A1TSHRMIFTRPA1CYP3A4
SCHEMBL10593333 0.76 MIF (0.42) ALDH1A1TSHRMIFTRPA1CYP3A4
SCHEMBL2241061 0.73 MIF (0.39) ALDH1A1TSHRMIFTRPA1CYP3A4
SCHEMBL6889221 0.73 MIF (0.39) ALDH1A1TSHRMIFTRPA1CYP3A4
SCHEMBL8763183 0.73 MIF (0.39) ALDH1A1TSHRMIFTRPA1CYP3A4
SCHEMBL7094056 0.68 MIF (0.35) ALDH1A1MIFTRPA1CYP3A4HPGD

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
EP-1841320-A2 METHODS AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR TREATING PSORIASIS S.U.L.V.E. Ltd. (IL) 2007-10-10 EP disclosed
WO-2006075330-A2 METHODS AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR TREATING PSORIASIS S.U.L.V.E. LTD. (IL) 2006-07-20 WO disclosed