SCHEMBL11040713

SCHEMBL11040713

C=CCCCC/C=C/[Si](C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
ALDH1A1 P00352 3/20 0.42
MAPT P10636 2/20 0.38
ABCC4 O15439 1/20 0.38
LMNA P02545 2/20 0.33
USP2 O75604 2/20 0.33
CYP3A4 P08684 1/20 0.33
RECQL P46063 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TRPA1 O75762 2/20 0.32
HPGD P15428 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL11040717 1.00 TSHR (0.44) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL28723430 0.87 TERT (0.31) MAPTLMNAUSP2RECQLTDP1
SCHEMBL28240702 0.81
SCHEMBL11122649 0.75 FAAH (0.50) MAPTLMNAUSP2RECQLTDP1
SCHEMBL18270282 0.75 FAAH (0.50) MAPTLMNAUSP2RECQLTDP1
SCHEMBL11122653 0.75 FAAH (0.50) MAPTLMNAUSP2RECQLTDP1
SCHEMBL18270292 0.75 FAAH (0.50) MAPTLMNAUSP2RECQLTDP1
SCHEMBL5436303 0.74 TSHR (0.53) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL5436307 0.74 TSHR (0.53) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL5951829 0.74 F7 (0.41) TSHRALDH1A1MAPTLMNAUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4454243-A REACTING LITHIUM AND AN ALKENE USING A TRANSITION OR ALKALI METAL COMPLEX STUDIENGESELLSCHAFT KOHLE MBH (DE) 1984-06-12 US disclosed
EP-0015541-B1 PROCESS FOR THE PREPARATION OF ORGANOLITHIUM COMPOUNDS BESIDES LITHIUM HYDRIDE; CATALYSTS Studiengesellschaft Kohle mbH (DE) 1984-03-07 EP disclosed
US-4354982-A Production of organolithium compounds and lithium hydride STUDIENGESELLSCHAFT KOHLE M.B.H. (DE) 1982-10-19 US disclosed
EP-0015541-A2 Process for the preparation of organolithium compounds besides lithium hydride; catalysts Studiengesellschaft Kohle mbH (DE) 1980-09-17 EP disclosed