SCHEMBL28023264

SCHEMBL28023264

FC(F)(F)c1cnn(-c2cncnc2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.42
CYP19A1 P11511 3/20 0.36
XDH P47989 2/20 0.36
CYP3A4 P08684 1/20 0.35
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
GABRB3 P28472 2/20 0.33
GRM4 Q14833 1/20 0.33
CYP46A1 Q9Y6A2 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRB2 P47870 1/20 0.33

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
SCHEMBL31403174 0.77 EPHX2 (0.51) EPHX2CYP19A1XDHCYP3A4MEN1
SCHEMBL3606688 0.76 GAA (0.55) EPHX2XDHMEN1NPC1RAB9A
SCHEMBL11900195 0.73 EPHX2 (0.44) EPHX2XDHMEN1NPC1RAB9A
SCHEMBL11901651 0.73 EPHX2 (0.55) EPHX2XDHMEN1NPC1RAB9A
SCHEMBL30173623 0.72 EPHX2 (0.40) EPHX2XDHMEN1NPC1RAB9A
SCHEMBL17076791 0.71 GAA (0.31)
SCHEMBL25777245 0.71 EPHX2 (0.45) EPHX2XDHCYP3A4MEN1NPC1
SCHEMBL1038150 0.70 CYP19A1 (0.52) CYP19A1CYP3A4CYP1A2METAP2
SCHEMBL5426693 0.69 SLC34A1 (0.38) EPHX2GRM4CYP46A1GCGR
SCHEMBL11900219 0.69 KIF11 (0.49) EPHX2CYP19A1XDHCYP3A4CYP11B2

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
CN-103370306-B Glucagon Receptor Modulators PFIZER INC. (US) 2015-12-02 CN disclosed
CN-104744370-A Glucagon receptor modulators PFIZER 2015-07-01 CN disclosed