SCHEMBL18946168

SCHEMBL18946168

CC#Cc1ccn2ccnc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.39
▸ OGA O60502 2/20 0.38
▸ QPCT Q16769 3/20 0.35
▸ PIK3C3 Q8NEB9 1/20 0.34
▸ MAPT P10636 1/20 0.33
▸ PIK3CD O00329 1/20 0.33
▸ ABL1 P00519 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ HCK P08631 1/20 0.33
▸ SRC P12931 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ PIK3CA P42336 1/20 0.33
▸ PIK3CB P42338 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ PIK3CG P48736 1/20 0.33
▸ EPHB4 P54760 1/20 0.33
▸ PRKDC P78527 1/20 0.33
▸ SSTR4 P31391 1/20 0.33
▸ KIT P10721 1/20 0.32
▸ DYRK1A Q13627 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
SCHEMBL25251508 0.83 OGA (0.39) GRM5OGAQPCTPIK3C3PIK3CD
SCHEMBL18946166 0.81 OGA (0.39) GRM5OGAQPCTPIK3C3PIK3CD
SCHEMBL3186168 0.79 OGA (0.35) GRM5OGAQPCTPIK3C3PIK3CD
SCHEMBL27046657 0.78 GRM5 (0.36) GRM5OGAQPCTPIK3C3
SCHEMBL29013300 0.78 PIK3C3 (0.35) GRM5OGAQPCTPIK3C3PIK3CD
SCHEMBL260041 0.78 CLK4 (0.38) GRM5QPCTPIK3C3
SCHEMBL3188485 0.78 PIK3C3 (0.38) GRM5OGAQPCTPIK3C3PIK3CD
Hydrochloric Acid SCHEMBL1799130 0.76 CLK4 (0.37) GRM5QPCTPIK3C3
SCHEMBL14144231 0.71 PIK3C3 (0.38) OGAQPCTPIK3C3PIK3CDABL1
SCHEMBL174229 0.71 DYRK1A (0.43) OGAQPCTPIK3C3MAPTPIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017093544-A1 ALKYNYL PHOSPHINE GOLD COMPLEXES FOR TREATING BACTERIAL INFECTIONS AUSPHERIX LIMITED (GB) 2017-06-08 — — WO disclosed
Send feedback