SCHEMBL17067745

SCHEMBL17067745

Cc1ncc(-c2ccc(F)nc2F)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 4/20 0.37
GRM5 P41594 3/20 0.36
VRK1 Q99986 1/20 0.34
CYP11B1 P15538 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2A6 P11509 1/20 0.33
CYP2B6 P20813 1/20 0.33
CYP2C19 P33261 1/20 0.33
HDAC4 P56524 1/20 0.33
CNR1 P21554 1/20 0.32
ABL1 P00519 3/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32
PTGS2 P35354 1/20 0.32
ROS1 P08922 1/20 0.31
PDE2A O00408 1/20 0.31
PDE7A Q13946 1/20 0.31
PDE10A Q9Y233 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL17067680 0.78 CYP11B2 (0.54) CYP11B2GRM5VRK1CYP11B1CYP2C19
SCHEMBL14934092 0.77 CYP11B2 (0.55) CYP11B2VRK1CYP11B1CYP3A4CYP2A6
SCHEMBL26951603 0.76 GRM5 (0.40) GRM5CYP3A4CYP2A6CYP2B6CYP2C19
SCHEMBL14934106 0.72 RPS6KA3 (0.41) VRK1
SCHEMBL19998622 0.71 PDGFRB (0.44) CYP11B2VRK1CYP3A4CYP2C19ABL1
SCHEMBL13713429 0.71 GRM5 (0.37) GRM5CNR1
SCHEMBL14934103 0.71 MAPT (0.43) CYP11B2CYP11B1PDE2APDE10A
SCHEMBL25699202 0.70 RAF1 (0.39) GRM5VRK1HDAC4ABL1CHRNB2
SCHEMBL13713428 0.69 CNR1 (0.33) GRM5CNR1
SCHEMBL17946108 0.69 PDGFRB (0.47) CYP11B2GRM5

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
EP-2773631-B1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2015-09-09 EP disclosed