SCHEMBL7025812

SCHEMBL7025812

CCC/C=C/[C@H]1CC[C@H](C2CCC(c3ccc(COCC)c(F)c3)CC2)CC1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.32
KDM4C Q9H3R0 1/20 0.32
KDM5B Q9UGL1 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
SCHEMBL8385724 1.00 KDM5A (0.32) KDM5AKDM4CKDM5B
SCHEMBL7026537 0.91 KDM5A (0.33) KDM5AKDM4CKDM5B
SCHEMBL8388235 0.91 KDM5A (0.33) KDM5AKDM4CKDM5B
SCHEMBL7033118 0.90 KDM5A (0.33) KDM5AKDM4CKDM5B
SCHEMBL8390265 0.90 KDM5A (0.33) KDM5AKDM4CKDM5B
SCHEMBL8389585 0.85
SCHEMBL7031723 0.85
SCHEMBL8387253 0.84 KDM5A (0.34) KDM5AKDM4CKDM5B
SCHEMBL7033040 0.84 KDM5A (0.34) KDM5AKDM4CKDM5B
SCHEMBL9250475 0.84 USP5 (0.33)

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-0754668-B1 Fluorobenzylether derivatives ROLIC AG (CH) 2003-02-05 EP disclosed
EP-0754668-A2 Fluorobenzylether derivatives Rolic AG (CH) 1997-01-22 EP disclosed