SCHEMBL7841597

SCHEMBL7841597

Cc1cc(OC(=O)O)c(C)c2c1SCCC2=O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
RXRG P48443 1/20 0.31
PTK2 Q05397 1/20 0.30

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
SCHEMBL7841595 0.78 KDM4E (0.36) KDM4EALDH1A1RXRARXRBRXRG
SCHEMBL7843121 0.75 TSHR (0.39) KDM4EALDH1A1
SCHEMBL7813372 0.73 KDM4E (0.38) KDM4EALDH1A1
SCHEMBL6725377 0.73 ALDH1A1 (0.32) KDM4EALDH1A1
SCHEMBL8135012 0.73 BRD4 (0.41) KDM4EALDH1A1
SCHEMBL7489687 0.70 VHL (0.32) KDM4E
SCHEMBL8128418 0.68 KDM4E (0.33) KDM4EALDH1A1PTK2
SCHEMBL8136278 0.68 KDM4E (0.34) KDM4EALDH1A1PTK2
SCHEMBL7840446 0.67 BRD4 (0.34) KDM4EALDH1A1
SCHEMBL984615 0.66 CYP3A4 (0.43) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1109807-A1 BENZOYL DERIVATIVES, METHOD FOR PRODUCING THEM AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS Aventis CropScience GmbH (DE) 2001-06-27 EP disclosed
WO-2000014087-A1 BENZOYL DERIVATIVES, METHOD FOR PRODUCING THEM AND THEIR USE AS HERBICIDES AND PLANT GROWTH REGULATORS AVENTIS CROPSCIENCE GMBH (DE) 2000-03-16 WO disclosed