SCHEMBL8318490

SCHEMBL8318490

CC(=O)OC/C(F)=C/C(C)(C)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.41
NR1H4 Q96RI1 1/20 0.41
TRPV1 Q8NER1 2/20 0.41
MAOB P27338 2/20 0.41
AOC3 Q16853 2/20 0.41
HPGD P15428 2/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 1/20 0.39
HDAC3 O15379 3/20 0.37
HDAC1 Q13547 3/20 0.37
HDAC2 Q92769 3/20 0.37
HDAC4 P56524 2/20 0.36
HDAC7 Q8WUI4 2/20 0.36
HDAC10 Q969S8 2/20 0.36
HDAC11 Q96DB2 2/20 0.36
HDAC8 Q9BY41 2/20 0.36
HDAC6 Q9UBN7 2/20 0.36
HDAC9 Q9UKV0 2/20 0.36
HDAC5 Q9UQL6 2/20 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
SCHEMBL8318493 1.00 EPHX2 (0.41) EPHX2NR1H4TRPV1MAOBAOC3
SCHEMBL8317481 0.84 ALDH1A1 (0.52) EPHX2NR1H4MAOBAOC3SMN1; SMN2
SCHEMBL8317478 0.84 ALDH1A1 (0.52) EPHX2NR1H4MAOBAOC3SMN1; SMN2
SCHEMBL8319359 0.82 GRIN2D (0.40) HPGDSMN1; SMN2POLBALDH1A1KMT2A
SCHEMBL8319358 0.82 GRIN2D (0.40) HPGDSMN1; SMN2POLBALDH1A1KMT2A
SCHEMBL8320991 0.80 MAOB (0.43) EPHX2NR1H4TRPV1MAOBAOC3
SCHEMBL8321000 0.80 MAOB (0.43) EPHX2NR1H4TRPV1MAOBAOC3
SCHEMBL8317595 0.74 TRPV1 (0.47) EPHX2NR1H4TRPV1HPGDTP53
SCHEMBL8317590 0.74 TRPV1 (0.47) EPHX2NR1H4TRPV1HPGDTP53
SCHEMBL8535184 0.73 SLC6A4 (0.41) EPHX2MAOBAOC3HPGDTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5880162-A INSECTICIDES FOR SOIL BORNE INSECT PESTS BRITISH TECHNOLOGY GROUP, LTD. (GB) 1999-03-09 US disclosed
EP-0757668-A1 PESTICIDAL FLUOROOLEFINS British Technology Group Ltd. (GB) 1997-02-12 EP disclosed
WO-1995029887-A1 PESTICIDAL FLUOROOLEFINS BRITISH TECHNOLOGY GROUP LIMITED (GB) 1995-11-09 WO disclosed