SCHEMBL6560503

SCHEMBL6560503

CC(C)CC(=O)C1CC1c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.51
HRH3 Q9Y5N1 3/20 0.51
SIGMAR1 Q99720 2/20 0.51
ALDH1A1 P00352 2/20 0.50
SLC9A1 P19634 1/20 0.47
GPR88 Q9GZN0 4/20 0.46
SLC25A5 P05141 1/20 0.46
HPGD P15428 1/20 0.45
KDM1A O60341 1/20 0.44

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
SCHEMBL6560500 1.00 HDAC4 (0.51) HDAC4HRH3SIGMAR1ALDH1A1SLC9A1
SCHEMBL17755392 0.83 GPR88 (0.47) HRH3SIGMAR1ALDH1A1SLC9A1GPR88
SCHEMBL14038418 0.81 HDAC4 (0.56) HDAC4HRH3SIGMAR1ALDH1A1SLC9A1
SCHEMBL26290355 0.81 HDAC4 (0.56) HDAC4HRH3SIGMAR1ALDH1A1SLC9A1
SCHEMBL14038424 0.81 HDAC4 (0.56) HDAC4HRH3SIGMAR1ALDH1A1SLC9A1
SCHEMBL6560499 0.81 HDAC4 (0.56) HDAC4HRH3SIGMAR1ALDH1A1SLC9A1
SCHEMBL13911289 0.81 HDAC4 (0.56) HDAC4HRH3SIGMAR1ALDH1A1SLC9A1
SCHEMBL8088723 0.77 HDAC4 (0.56) HDAC4HRH3SIGMAR1ALDH1A1SLC9A1
SCHEMBL14767822 0.77 ALDH1A1 (0.59) HDAC4SIGMAR1ALDH1A1SLC9A1HPGD
SCHEMBL14012771 0.77 HDAC4 (0.56) HDAC4HRH3SIGMAR1ALDH1A1SLC9A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1301983-C Aromatic group and heteroaryl cyclopropyl oximinoether and application uses as fungicide and pesticide ROHM & HAAS (US) 2007-02-28 CN disclosed
EP-1120403-B1 Aryl and heteroarylcyclopropyl oxime ethers and their use as fungicides and insecticides DOW AGROSCIENCES LLC (US) 2004-03-17 EP disclosed
US-6313339-B1 Aryl and heteroarylcylopropyl oxime ethers and their use as fungicides and insecticides ROHM AND HAAS ASIA, INC. 2001-11-06 US disclosed
CN-1319586-A Aromatic group and heteroaryl cyclopropyl oximinoether and application uses as fungicide and pesticide ROHM & HAAS (US) 2001-10-31 CN disclosed
EP-1120403-A2 Aryl and heteroarylcyclopropyl oxime ethers and their use as fungicides and insecticides ROHM AND HAAS COMPANY (US) 2001-08-01 EP disclosed