SCHEMBL2951235

SCHEMBL2951235

CCCOS(=O)(=O)c1ccc(C)cc1C1COC1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA9 Q16790 1/20 0.31
TSHR P16473 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MCOLN3 Q8TDD5 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
SCHEMBL28081455 0.92 CA2 (0.34) LMNACA12CA1CA9TSHR
SCHEMBL28467370 0.89 TSHR (0.34) LMNATSHRMEN1KMT2AALDH1A1
SCHEMBL17316352 0.82 MCOLN3 (0.35) LMNATSHRKMT2AALDH1A1MCOLN3
SCHEMBL3918082 0.76 ALDH1A1 (0.38) LMNATSHRMEN1KMT2AALDH1A1
SCHEMBL5792421 0.76 ALDH1A1 (0.35) LMNACA1MEN1KMT2AALDH1A1
SCHEMBL1708608 0.74 POLB (0.38) CA1CA9TSHRMEN1KMT2A
SCHEMBL28704162 0.74 PTGDR2 (0.42) TSHRMEN1KMT2AMCOLN3
SCHEMBL5552171 0.73 KAT6A (0.40) LMNACA1MEN1KMT2AALDH1A1
SCHEMBL17476551 0.72 ALDH1A1 (0.36) LMNATSHRKMT2AALDH1A1MCOLN3
SCHEMBL30195988 0.72 ALDH1A1 (0.38) CA1TSHRMEN1KMT2AALDH1A1

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-7759503-B2 Trisoxetane compound, process for producing the same, and optical waveguide using the same NITTO DENKO CORPORATION (JP) 2010-07-20 US disclosed