SCHEMBL8953736

SCHEMBL8953736

CCCCCCCC1OCC(c2ccc(-c3ccc(-c4ccc(OCCC)c(F)c4F)cc3)c(F)c2)CO1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 14/20 0.38
RARB P10826 1/20 0.32
PDE4A P27815 3/20 0.31
KDM1A O60341 2/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31

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
SCHEMBL8953405 0.99 FPR2 (0.38) FPR2PDE4AKDM1APDE4BPDE4C
SCHEMBL8953695 0.97 FPR2 (0.36) FPR2RARBPDE4AKDM1APDE4B
SCHEMBL8953720 0.97 FPR2 (0.36) FPR2RARBPDE4AKDM1APDE4B
SCHEMBL8953613 0.97 FPR2 (0.36) FPR2RARBPDE4AKDM1APDE4B
SCHEMBL8953544 0.97 FPR2 (0.36) FPR2RARBPDE4AKDM1APDE4B
SCHEMBL8953724 0.97 FPR2 (0.36) FPR2RARBPDE4AKDM1APDE4B
SCHEMBL8953332 0.97 FPR2 (0.36) FPR2RARBPDE4AKDM1APDE4B
SCHEMBL8953675 0.97 FPR2 (0.36) FPR2RARBPDE4AKDM1APDE4B
SCHEMBL8953290 0.97 FPR2 (0.36) FPR2RARBPDE4AKDM1APDE4B
SCHEMBL8953752 0.97 FPR2 (0.35) FPR2RARBPDE4AKDM1APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed