SCHEMBL6894881

SCHEMBL6894881

[c]1c2on1c1ccccc21

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
POLB P06746 2/20 0.32
NR4A2 P43354 1/20 0.32
CYP19A1 P11511 1/20 0.31
ALDH1A1 P00352 2/20 0.31
KMT2A Q03164 2/20 0.31
MITF O75030 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HTT P42858 1/20 0.31
BACE1 P56817 2/20 0.30
MEN1 O00255 1/20 0.30

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
SCHEMBL450895 0.59 GPR3 (0.34) GPR3CYP1A2CYP2C19KDM4EATM
SCHEMBL10617464 0.58 GPR3 (0.58) GPR3CYP1A2CYP2C19KDM4EATM
SCHEMBL29364414 0.58 GPR3 (0.58) GPR3CYP1A2CYP2C19KDM4EATM
SCHEMBL29462713 0.58 L3MBTL1 (0.84) GPR3CYP1A2CYP2C19KDM4EATM
SCHEMBL31397606 0.58 L3MBTL1 (0.84) GPR3CYP1A2CYP2C19KDM4EATM
SCHEMBL77361 0.58 L3MBTL1 (0.84) GPR3CYP1A2CYP2C19KDM4EATM
SCHEMBL13562922 0.57 KDM4E (0.70) GPR3CYP1A2CYP2C19KDM4EATM
SCHEMBL18381783 0.57 L3MBTL1 (0.80) GPR3CYP1A2CYP2C19KDM4EATM
SCHEMBL11959493 0.56 GPR3 (0.55) GPR3CYP1A2CYP2C19KDM4EATM
SCHEMBL4875660 0.56 GPR3 (0.55) GPR3CYP1A2CYP2C19KDM4EATM

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-6699853-B2 PROTECTING USEFUL PLANTS AGAINST THE UNDESIRABLE ACTION OF HARMFUL INSECTS, ACARIDS AND NEMATODES, HOECHST SCHERING AGREVO GMBH (DE) 2004-03-02 US disclosed