SCHEMBL14047646

SCHEMBL14047646

CC(Oc1ccc(Oc2ccc(Oc3c(C=O)c(C)nn3C)cc2)c(Cl)c1)=C(Cl)Cl

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.60
CYP1A2 P05177 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP2C19 P33261 2/20 0.53
MAPT P10636 3/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 2/20 0.38
CYP3A4 P08684 1/20 0.34
GPBAR1 Q8TDU6 2/20 0.34
NPSR1 Q6W5P4 1/20 0.33
ALDH1A1 P00352 2/20 0.31
KMT2A Q03164 2/20 0.31
HTT P42858 3/20 0.31
NR2F2 P24468 1/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
CHEK2 O96017 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
SCHEMBL13266731 0.87 SMN1; SMN2 (0.67) SMN1; SMN2CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL876603 0.78 SMN1; SMN2 (0.73) SMN1; SMN2CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL24162679 0.77 SMN1; SMN2 (0.67) SMN1; SMN2CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL26719555 0.77 SMN1; SMN2 (0.60) SMN1; SMN2CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL2071589 0.76 SMN1; SMN2 (1.00) SMN1; SMN2CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL13452319 0.76 SMN1; SMN2 (0.50) SMN1; SMN2CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL13266640 0.76 SMN1; SMN2 (0.50) SMN1; SMN2CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL13266500 0.75 SMN1; SMN2 (0.49) SMN1; SMN2CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL3614492 0.74 SMN1; SMN2 (0.57) SMN1; SMN2CYP1A2CYP2C9CYP2C19MAPT
SCHEMBL13266641 0.74 SMN1; SMN2 (0.46) SMN1; SMN2CYP1A2CYP2C9CYP2C19MAPT

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-7442801-B2 used for controlling noxious arthropods; miticides; pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-10-28 US disclosed