SCHEMBL5423344

SCHEMBL5423344

CCCCCCCCCCC=C1CO1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
PRKCA P17252 6/20 0.40
PPARG P37231 2/20 0.39
PDIA3 P30101 1/20 0.38
PDIA6 Q15084 1/20 0.38
TYR P14679 1/20 0.38
FAAH O00519 2/20 0.37
TRPV1 Q8NER1 1/20 0.37
THRB P10828 1/20 0.36

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
Water SCHEMBL10770583 0.92 FAAH (0.45) TSHRPPARGFAAHTRPV1
SCHEMBL2029410 0.82 APOBEC3A (0.37) TSHRPRKCAPPARGPDIA3PDIA6
SCHEMBL2029412 0.82 APOBEC3A (0.37) TSHRPRKCAPPARGPDIA3PDIA6
SCHEMBL22046452 0.75 TSHR (0.44) TSHRPRKCAPPARGTYRFAAH
SCHEMBL2027735 0.73 TSHR (0.36) TSHRPRKCAPPARGPDIA3PDIA6
SCHEMBL1797486 0.71 TSHR (0.44) TSHRPRKCAPPARGFAAHTRPV1
SCHEMBL21300 0.71 TSHR (0.44) TSHRPRKCAPPARGFAAHTRPV1
SCHEMBL15618662 0.71 TSHR (0.44) TSHRPRKCAPPARGFAAHTRPV1
SCHEMBL14915686 0.71 TSHR (0.44) TSHRPRKCAPPARGFAAHTRPV1
SCHEMBL15618384 0.71 TSHR (0.44) TSHRPRKCAPPARGFAAHTRPV1

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-20070197751-A1 Olefin polymerization catalyst system useful for polar monomers EXXONMOBIL CHEMICAL PATENTS INC. 2007-08-23 US claimed