SCHEMBL4383056

SCHEMBL4383056

CCC(=O)OC1CC2(C)OC1C(C(F)(F)F)=C2C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.33
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 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
SCHEMBL4385016 0.74 CHRM2 (0.33) BCHECHRM2CHRM4CHRM1CHRM3
SCHEMBL28684224 0.61 CHRM2 (0.40) BCHECHRM2CHRM4CHRM1CHRM3
SCHEMBL3437068 0.59 ATM (0.35)
SCHEMBL12833084 0.59 CHRM2 (0.36) CHRM2CHRM4CHRM1CHRM3
SCHEMBL20787030 0.59 ALDH1A1 (0.36) CHRM2CHRM4CHRM1CHRM3
SCHEMBL28841776 0.58 CHRM2 (0.43) BCHECHRM2CHRM4CHRM1CHRM3
SCHEMBL30142118 0.58 CHRM2 (0.43) BCHECHRM2CHRM4CHRM1CHRM3
SCHEMBL20613294 0.57 CHRM2 (0.41) BCHECHRM2CHRM4CHRM1CHRM3
SCHEMBL2574215 0.57 CHRM2 (0.37) BCHECHRM2CHRM4CHRM1CHRM3
SCHEMBL19638263 0.57 CHRM2 (0.37) BCHECHRM2CHRM4CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8211984-B2 Ring-opening metathesis polymer, hydrogenated product thereof, method for preparing the same, and use thereof MITSUI CHEMICALS, INC. (JP) 2012-07-03 US disclosed
US-20090215974-A1 RING-OPENING METATHESIS POLYMER, HYDROGENATED PRODUCT THEREOF, METHOD FOR PREPARING THE SAME, AND USE THEREOF MITSUI CHEMICALS INC (JP) 2009-08-27 US disclosed
EP-2045280-A1 RING-OPENING METATHESIS POLYMERS, PRODUCTS OF HYDROGENATION THEREOF, PROCESS FOR PRODUCTION OF THE SAME AND USES THEREOF Mitsui Chemicals, Inc. (JP) 2009-04-08 EP disclosed