SCHEMBL11245808

SCHEMBL11245808

O=C(NC(=O)c1ccccc1Cl)Nc1ccc(OCc2ccccc2)c(Cl)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.64
PYGL P06737 2/20 0.58
ACP1 P24666 1/20 0.57
PTPN12 Q05209 1/20 0.57
PTPN13 Q12923 1/20 0.57
SSU72 Q9NP77 1/20 0.57
NPC1 O15118 1/20 0.53
POLB P06746 1/20 0.53
PKM P14618 1/20 0.53
RAB9A P51151 1/20 0.53
PNLIP P16233 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
EGFR P00533 4/20 0.50
ERBB2 P04626 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
PLCG2 P16885 1/20 0.50
KCNH2 Q12809 1/20 0.49
PPIA P62937 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL11237411 0.93 GCGR (0.71) GCGRPYGLACP1PTPN12PTPN13
SCHEMBL11251747 0.90 GCGR (0.55) GCGRPYGLACP1PTPN12PTPN13
SCHEMBL11388824 0.89 GCGR (0.62) GCGRPYGLNPC1POLBPKM
SCHEMBL11238696 0.89 GCGR (0.57) GCGRPYGLACP1PTPN12PTPN13
SCHEMBL11242220 0.87 S1PR1 (0.61) GCGRPYGLNPC1POLBPKM
SCHEMBL11246087 0.87 TDP1 (0.70) GCGRPYGLACP1PTPN12PTPN13
SCHEMBL11243077 0.86 PYGL (0.69) GCGRPYGLNPC1POLBPKM
SCHEMBL11250867 0.85 TDP1 (0.63) GCGRPYGLNPC1RAB9ATDP1
SCHEMBL11247921 0.84 GCGR (0.59) GCGRPYGLNPC1POLBPKM
SCHEMBL11244138 0.84 GCGR (0.61) GCGRPYGLNPC1POLBPKM

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
US-4350706-A MITICIDES, LARVICIDES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1982-09-21 US disclosed