SCHEMBL696264

SCHEMBL696264

Cc1c(C(F)(F)F)cccc1C(C)(O)c1nccn1Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.42
P2RX7 Q99572 3/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
OPRD1 P41143 3/20 0.39
HSD17B10 Q99714 1/20 0.38
HSD11B1 P28845 1/20 0.38
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38
OPRK1 P41145 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
POLB P06746 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HSP90AA1 P07900 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL696963 0.88 MEN1 (0.41) MEN1KMT2AOPRD1HSD17B10OPRK1
SCHEMBL697954 0.86 MEN1 (0.39) MEN1KMT2AOPRD1HSD17B10OPRK1
SCHEMBL11345241 0.84 MEN1 (0.43) MEN1KMT2AOPRD1HSD17B10OPRK1
SCHEMBL697374 0.84 MEN1 (0.39) TP53P2RX7MEN1KMT2AOPRD1
SCHEMBL697554 0.81 MEN1 (0.39) MEN1KMT2AOPRD1HSD17B10OPRK1
SCHEMBL697120 0.81 MEN1 (0.44) TP53P2RX7MEN1KMT2AOPRD1
SCHEMBL27733466 0.80 OPRD1 (0.39) TP53MEN1KMT2AOPRD1OPRK1
SCHEMBL697949 0.78 KMT2A (0.37) MEN1KMT2AOPRD1HSD17B10OPRK1
SCHEMBL17810214 0.77 HSD17B10 (0.48) MEN1KMT2AHSD17B10TDP1ALDH1A1
SCHEMBL27733620 0.76 OPRD1 (0.39) MEN1KMT2AOPRD1OPRK1TDP1

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 4 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
CN-101370786-B Substituted imidazoles and their use as pesticides PFIZER 2012-01-11 CN disclosed
EP-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP disclosed
CN-101370786-A Substituted imidazoles and their use as pesticides PFIZER LTD (GB) 2009-02-18 CN disclosed