SCHEMBL8876992

SCHEMBL8876992

O=C(O)c1c2ccccc2nc2cccc(OCc3c(F)ccc(F)c3F)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 2/20 0.39
GUCY1B2 O75343 1/20 0.38
GUCY1A2 P33402 1/20 0.38
GUCY1A1 Q02108 1/20 0.38
GUCY1B1 Q02153 1/20 0.38
LMNA P02545 2/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
DCPS Q96C86 2/20 0.37
MRGPRX4 Q96LA9 2/20 0.37
GAA P10253 2/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PDE10A Q9Y233 2/20 0.36
ANO1 Q5XXA6 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL6696696 0.75 LTB4R (0.44) LMNANPC1RAB9AALDH1A1PDE10A
SCHEMBL4188279 0.74 RAB9A (0.42) LMNANPC1RAB9AMEN1KMT2A
SCHEMBL5839896 0.73 ALDH1A1 (0.54) LMNANPC1KMT2AMRGPRX4ALDH1A1
SCHEMBL9429117 0.71 TOP2A (0.43) LMNADCPSMRGPRX4ALDH1A1POLB
SCHEMBL8332290 0.70 GUCY1B2 (0.32) GUCY1B2GUCY1A2GUCY1A1GUCY1B1MRGPRX4
SCHEMBL8333267 0.70 RAB9A (0.41) NPC1RAB9AMEN1KMT2AGAA
SCHEMBL14917525 0.67 DHODH (0.53) LMNANPC1RAB9AMEN1KMT2A
SCHEMBL9330379 0.66 PDE10A (0.44) DHFRLMNAMEN1KMT2APOLB
SCHEMBL27802771 0.66 PDE10A (0.50) LMNANPC1RAB9AMEN1KMT2A
SCHEMBL7590081 0.66 PDE10A (0.58) LMNAMEN1KMT2AALDH1A1POLB

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-5593845-A BY REACTION WITH PEROXIDES AND PEROXIDASE; DETECTION OF HAPTENS, PROTEINS, ANTIBODIES IN ENZYME IMMUNOASSAY LUMIGEN, INC. (US) 1997-01-14 US disclosed