SCHEMBL7621992

SCHEMBL7621992

CO/C(C)=C(/C(=O)O)c1ccccc1Oc1cccc(Oc2cccc(C#N)c2)c1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
MTNR1B P49286 1/20 0.40
PYGL P06737 1/20 0.40
PYGM P11217 1/20 0.40
CCR2 P41597 1/20 0.39
HTT P42858 1/20 0.39
AR P10275 1/20 0.39
RAB9A P51151 1/20 0.39
PGR P06401 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
RXFP1 Q9HBX9 1/20 0.38
STK10 O94804 1/20 0.38
SLK Q9H2G2 1/20 0.38
PTGER4 P35408 1/20 0.38
PTGER2 P43116 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL205000 1.00 KDM4E (0.41) KDM4EPOLBMTNR1BPYGLPYGM
SCHEMBL204999 0.90 KDM4E (0.40) KDM4EPOLBPYGLPYGMHTT
SCHEMBL202626 0.85 KDM4E (0.57) KDM4EPOLBMTNR1BPYGMRAB9A
SCHEMBL203718 0.82 CTNNB1 (0.54) KDM4EHTTRAB9AMEN1KMT2A
SCHEMBL203989 0.81 KDM4E (0.44) KDM4EPOLBMTNR1BHTTRAB9A
SCHEMBL204355 0.81 L3MBTL1 (0.44) KDM4EPOLBMTNR1BRAB9AMEN1
SCHEMBL18772927 0.81 AR (0.45) KDM4EPOLBHTTARRAB9A
SCHEMBL203538 0.81 LMNA (0.51) KDM4EPOLBMTNR1BRAB9ASMN1; SMN2
SCHEMBL2852479 0.81 KDM4E (0.40) KDM4EPOLBPYGLPYGMHTT
SCHEMBL9155384 0.80 SIRT2 (0.47) KDM4EPOLBMTNR1BHTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1221845-A1 ACTIVE INGREDIENT COMBINATIONS HAVING INSECTICIDAL AND ACARICIDAL PROPERTIES Bayer Aktiengesellschaft (DE) 2002-07-17 EP disclosed
WO-2001024634-A1 ACTIVE INGREDIENT COMBINATIONS HAVING INSECTICIDAL AND ACARICIDAL PROPERTIES BAYER AKTIENGESELLSCHAFT (DE) 2001-04-12 WO disclosed
EP-0871362-A1 SYNERGISTIC INSECTICIDE MIXTURES BAYER AG (DE) 1998-10-21 EP disclosed
EP-0865436-A1 DITHIAZOLDIOXIDES AND THE USE THEREOF AS MICROBICIDES BAYER AG (DE) 1998-09-23 EP disclosed
EP-0847386-A1 N-SULFONYLIMINODITHIO COMPOUNDS USEFUL FOR PLANT AND MATERIAL PROTECTION BAYER AG (DE) 1998-06-17 EP disclosed
EP-0815085-A1 THIOCARBAMOYL COMPOUNDS BAYER AG (DE) 1998-01-07 EP disclosed
EP-0785718-A1 INSECTICIDES BAYER AG (DE) 1997-07-30 EP disclosed
WO-1997024032-A1 SYNERGISTIC INSECTICIDE MIXTURES BAYER AKTIENGESELLSCHAFT (DE) 1997-07-10 WO disclosed
WO-1997020830-A1 DITHIAZOLDIOXIDES AND THE USE THEREOF AS MICROBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-06-12 WO disclosed
WO-1997008140-A1 N-SULFONYLIMINODITHIO COMPOUNDS USEFUL FOR PLANT AND MATERIAL PROTECTION BAYER AKTIENGESELLSCHAFT (DE) 1997-03-06 WO disclosed
WO-1996029314-A1 THIOCARBAMOYL COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 1996-09-26 WO disclosed
WO-1996025044-A1 S-ARYL CYANIMIDOTHIO COMPOUNDS FOR MATERIAL PROTECTION BAYER AKTIENGESELLSCHAFT (DE) 1996-08-22 WO disclosed
WO-1996010915-A1 INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-04-18 WO disclosed