SCHEMBL6792041

SCHEMBL6792041

Cc1cc(C(F)(F)F)cc(C=O)n1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
NR2E1 Q9Y466 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 2/20 0.33
HTT P42858 1/20 0.33
CCR1 P32246 1/20 0.33
SORT1 Q99523 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
RAD51 Q06609 1/20 0.33
CES2 O00748 1/20 0.32
POLQ O75417 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL10025587 0.79 HSP90AA1 (0.46) HSP90AA1HSP90AB1NR2E1GAAHTT
SCHEMBL29175684 0.77 CYP3A4 (0.35) KDM4EALDH1A1MAPTCES2LMNA
SCHEMBL4018885 0.77 CES2 (0.36) KDM4EMAPTCES2
SCHEMBL4017102 0.77 CES2 (0.32) CES2
SCHEMBL27602512 0.77 GAA (0.39) HSP90AA1HSP90AB1KDM4EGAASORT1
SCHEMBL29600243 0.73 NOS2 (0.44) KDM4EALDH1A1CCR1NPC1MAPT
SCHEMBL1646533 0.73 NOS2 (0.44) KDM4EALDH1A1CCR1NPC1MAPT
SCHEMBL31448288 0.73 HSP90AA1 (0.42) HSP90AA1HSP90AB1NR2E1GAAHTT
SCHEMBL4016343 0.72 TACR1 (0.36) KDM4EALDH1A1GAASMN1; SMN2LMNA
SCHEMBL9737789 0.71 HSP90AA1 (0.41) HSP90AA1HSP90AB1NR2E1KDM4EGAA

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
CN-1511140-A Oxime ether compound and agricultural or horticultural bactericide �ձ�������ʽ���� 2004-07-07 CN disclosed
US-20040116480-A1 Oxime ether compound and agricultural or horticultural bactericide NIPPON SODA CO., LTD. (JP) 2004-06-17 US disclosed
EP-1362850-A1 OXIME ETHER COMPOUND AND AGRICULTURAL OR HORTICULTURAL BACTERICIDE NIPPON SODA CO., LTD. (JP) 2003-11-19 EP disclosed