SCHEMBL7811068

SCHEMBL7811068

CSc1c(C(C)=O)c(=O)[nH]c2c(C(F)(F)F)c(F)ccc12

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
PADI4 Q9UM07 1/20 0.33
XDH P47989 1/20 0.31
BRAF P15056 1/20 0.31
CAPN1 P07384 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
SCHEMBL7809628 0.79 KDM4E (0.43) KDM4EPADI4
SCHEMBL7809564 0.79 CAPN1 (0.46) KDM4EPADI4CAPN1
SCHEMBL7809688 0.74 CAPN1 (0.40) KDM4EPADI4BRAFCAPN1
SCHEMBL7813746 0.74 KDM4E (0.35) KDM4EPADI4
SCHEMBL7809501 0.72 CAPN1 (0.34) KDM4EPADI4CAPN1
SCHEMBL7810952 0.71 RXFP1 (0.47) KDM4EPADI4
SCHEMBL7813180 0.69 KDM4E (0.44) KDM4EPADI4
SCHEMBL7816993 0.68 KDM4E (0.41) KDM4EPADI4XDH
SCHEMBL7816823 0.68 KDM4E (0.65) KDM4EPADI4
SCHEMBL29612326 0.68 KDM4E (0.65) KDM4EPADI4

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-0533882-B1 2-QUINOLINONE DERIVATIVES, METHODS FOR PREPARING THE SAME AND FUNGICIDES AND INSECTICIDES INCLUDING THEM KOREA RES INST CHEM TECH (KR) 2001-02-07 EP disclosed
US-5430153-A Insecticides, fungicides KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-07-04 US disclosed