SCHEMBL17067680

SCHEMBL17067680

Cc1ncc(-c2cccnc2F)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 2/20 0.54
CYP11B1 P15538 1/20 0.52
MAPT P10636 2/20 0.45
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
DHODH Q02127 3/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
PDE2A O00408 2/20 0.39
PDE10A Q9Y233 2/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNA6 Q15825 1/20 0.39
TDO2 P48775 1/20 0.38
CYP2C19 P33261 1/20 0.38
GRIA2 P42262 1/20 0.38
VRK1 Q99986 1/20 0.37
GRM5 P41594 2/20 0.36
KCNH2 Q12809 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
PDE5A O76074 1/20 0.35

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
SCHEMBL17067677 0.84 KDM4E (0.42) CYP11B2CYP11B1MAPTPTGS1PTGS2
SCHEMBL14934135 0.81 CYP11B2 (0.57) CYP11B2CYP11B1MAPTMAOAMAOB
SCHEMBL17067745 0.78 CYP11B2 (0.37) CYP11B2CYP11B1PTGS2PDE2APDE10A
SCHEMBL11245926 0.78 PTGS1 (0.46) CYP11B2CYP11B1PTGS1PTGS2DHODH
SCHEMBL26951542 0.76 MAOA (0.46) CYP11B2CYP11B1MAPTDHODHMAOA
SCHEMBL14934106 0.75 RPS6KA3 (0.41) DHODHVRK1KCNH2
SCHEMBL13750510 0.75 DHODH (0.46) CYP11B2CYP11B1MAPTPTGS2DHODH
SCHEMBL17946108 0.72 PDGFRB (0.47) CYP11B2GRM5
SCHEMBL15730119 0.72 MKNK1 (0.44) MAPTPTGS1PTGS2DHODHPDE2A
SCHEMBL14934101 0.72 CYP2A6 (0.56) CYP11B2CYP11B1

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