SCHEMBL2354299

SCHEMBL2354299

CC(C)CN(C(=O)C(F)(F)F)[SiH](C)C

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 3/20 0.39
CHRM2 P08172 3/20 0.36
CHRM4 P08173 3/20 0.36
CHRM5 P08912 3/20 0.36
CHRM1 P11229 3/20 0.36
CHRM3 P20309 3/20 0.36
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34

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
SCHEMBL6675892 0.76 CHRM2 (0.35) MLYCDCHRM2CHRM4CHRM5CHRM1
SCHEMBL19892574 0.74 CHRM2 (0.42) MLYCDCHRM2CHRM4CHRM5CHRM1
SCHEMBL5620718 0.72 CHRM2 (0.30) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4439111 0.68 FAAH (0.44)
SCHEMBL3618071 0.67 CHRM2 (0.31) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL11924542 0.67 CTSK (0.48) MLYCDCHRM2CHRM4CHRM5CHRM1
SCHEMBL3643142 0.66 CHRM2 (0.33) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL24256429 0.65 ALDH1A1 (0.36) MLYCDCHRM2CHRM4CHRM5CHRM1
SCHEMBL11924539 0.64 CTSK (0.50) MLYCDCHRM2CHRM4CHRM5CHRM1
SCHEMBL31206494 0.64 CHRM2 (0.41) MLYCDCHRM2CHRM4CHRM5CHRM1

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-2344652-A1 ETHANOL PRODUCTION BY MICROORGANISMS Joule Unlimited, Inc. (US) 2011-07-20 EP disclosed
WO-2010044960-A1 ETHANOL PRODUCTION BY MICROORGANISMS JOULE BIOTECHNOLOGIES, INC. (US) 2010-04-22 WO disclosed