SCHEMBL706070

SCHEMBL706070

CC(O)(c1ncc[nH]1)c1cccc(Cl)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.48
ADRA2A P08913 1/20 0.40
ADRA2C P18825 1/20 0.40
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40
TAAR1 Q96RJ0 2/20 0.39
KMT2A Q03164 3/20 0.36
F2RL1 P55085 3/20 0.35
MDM2 Q00987 1/20 0.33
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
PDK1 Q15118 1/20 0.31
PDK2 Q15119 1/20 0.31
PDK3 Q15120 1/20 0.31
PDK4 Q16654 1/20 0.31
P2RX7 Q99572 1/20 0.31
CYP3A4 P08684 2/20 0.31
TSHR P16473 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
SCHEMBL6299558 0.88 CYP19A1 (0.46) CYP19A1ADRA2AADRA2CADRA1DADRA1A
SCHEMBL699180 0.87 CYP19A1 (0.47) CYP19A1ADRA2AADRA2CADRA1DADRA1A
SCHEMBL698787 0.87 CYP19A1 (0.43) CYP19A1ADRA2AADRA2CADRA1DADRA1A
SCHEMBL697435 0.86 CYP19A1 (0.46) CYP19A1ADRA2AADRA2CADRA1DADRA1A
SCHEMBL698375 0.83 CYP19A1 (0.40) CYP19A1ADRA2AADRA2CADRA1DADRA1A
SCHEMBL27733481 0.82 TAAR1 (0.43) CYP19A1ADRA2AADRA2CADRA1DADRA1A
SCHEMBL697775 0.79 TAAR1 (0.44) CYP19A1TAAR1KMT2ACYP3A4TSHR
SCHEMBL1573354 0.78 TAAR1 (0.40) CYP19A1ADRA2AADRA2CADRA1DADRA1A
SCHEMBL7914818 0.77 CYP19A1 (0.51) CYP19A1TAAR1KMT2AMDM2PDK1
SCHEMBL697917 0.77 CYP19A1 (0.38) CYP19A1TAAR1F2RL1MDM2

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