SCHEMBL697534

SCHEMBL697534

CC(O)(c1cccc(C(F)(F)F)c1)c1ncc[nH]1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.41
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KMO O15229 2/20 0.37
CYP2C8 P10632 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
IDO1 P14902 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
ALDH1A1 P00352 1/20 0.36
IDH2 P48735 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
CES2 O00748 1/20 0.36
MGLL Q99685 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.36
SCN2A Q99250 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
SCHEMBL697313 0.85 CYP19A1 (0.41) CYP19A1
SCHEMBL697452 0.84 CYP19A1 (0.49) CYP19A1MEN1KMT2ATAAR1CES2
SCHEMBL705114 0.84 CYP19A1 (0.42) CYP19A1MEN1KMT2AKMOCYP2C8
SCHEMBL696425 0.82 KCNH2 (0.42) CYP19A1
SCHEMBL697717 0.82 CYP19A1 (0.51) CYP19A1MEN1KMT2AIDO1TAAR1
SCHEMBL11536872 0.81 CYP19A1 (0.54) CYP19A1MEN1KMT2AKMOCYP2D6
SCHEMBL6302051 0.81 CYP19A1 (0.47) CYP19A1MEN1KMT2ATAAR1ALDH1A1
SCHEMBL697087 0.81 CYP19A1 (0.47) CYP19A1MEN1KMT2ATAAR1ALDH1A1
SCHEMBL27733475 0.79 CYP19A1 (0.38) CYP19A1ALDH1A1
SCHEMBL696829 0.78 TAAR1 (0.44) CYP19A1CYP2D6CYP2C9TAAR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2423199-A1 Substituted imidazoles and their use as pesticides Pfizer Limited (GB) 2012-02-29 EP disclosed
EP-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP disclosed