SCHEMBL697717

SCHEMBL697717

CC(O)(c1cccc(Cl)c1)c1ncc[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 4/20 0.51
TAAR1 Q96RJ0 2/20 0.39
MDM2 Q00987 1/20 0.38
RORC P51449 2/20 0.34
SCN5A Q14524 3/20 0.34
SCN9A Q15858 3/20 0.34
NUDT1 P36639 1/20 0.34
CNR2 P34972 1/20 0.34
VNN1 O95497 1/20 0.34
CYP17A1 P05093 1/20 0.34
CYP3A4 P08684 1/20 0.34
ADRA2A P08913 1/20 0.33
ADRA2C P18825 1/20 0.33
ADRA1D P25100 1/20 0.33
ADRA1A P35348 1/20 0.33
ADRA1B P35368 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
IDO1 P14902 1/20 0.33
F2RL1 P55085 1/20 0.33

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
SCHEMBL705114 0.84 CYP19A1 (0.42) CYP19A1TAAR1MDM2CNR2CYP3A4
SCHEMBL697313 0.82 CYP19A1 (0.41) CYP19A1MDM2F2RL1
SCHEMBL697534 0.82 CYP19A1 (0.41) CYP19A1TAAR1MEN1KMT2AIDO1
SCHEMBL11533065 0.81 CYP19A1 (0.66) CYP19A1TAAR1RORCIDO1
SCHEMBL697087 0.81 CYP19A1 (0.47) CYP19A1TAAR1CYP3A4MEN1KMT2A
SCHEMBL6302051 0.81 CYP19A1 (0.47) CYP19A1TAAR1CYP3A4MEN1KMT2A
SCHEMBL698661 0.81 CYP19A1 (0.53) CYP19A1MDM2ADRA2AADRA2CADRA1D
SCHEMBL697370 0.79 CYP19A1 (0.51) CYP19A1MDM2ADRA2AADRA2CADRA1D
SCHEMBL27733475 0.79 CYP19A1 (0.38) CYP19A1MDM2CYP3A4
SCHEMBL699118 0.78 CYP19A1 (0.50) CYP19A1MDM2CYP3A4MEN1KMT2A

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