SCHEMBL9688178

SCHEMBL9688178

Cc1cc2c(cc1C)C(c1ccccc1)(C(F)(F)F)c1cc3c(cc1O2)C(c1ccccc1)(C(F)(F)F)c1cc(C)c(C)cc1O3

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 1/20 0.32
PDK2 Q15119 2/20 0.31
CNR1 P21554 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
SCHEMBL8797540 0.86 CNR1 (0.32) CNR1
SCHEMBL23149793 0.85 PDK2 (0.36) GPR35PDK2
SCHEMBL9455630 0.84 CNR1 (0.31) CNR1
SCHEMBL8797522 0.84
SCHEMBL8797530 0.81
SCHEMBL9687408 0.81
SCHEMBL9455519 0.79 PDK2 (0.31) PDK2
SCHEMBL7088056 0.79 TP53 (0.31)
SCHEMBL9221863 0.78 PDK2 (0.37) GPR35PDK2CNR1
SCHEMBL11887457 0.77 TDP1 (0.34) PDK2

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
EP-0500026-A1 Compounds, monomers, and polymers based on perfluoroalkyl and perfluoroalkyl-aryl dioxapentacene E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-08-26 EP disclosed