SCHEMBL5853849

SCHEMBL5853849

C/C=C/CC(CC)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
CCR5 P51681 1/20 0.40
TAAR1 Q96RJ0 4/20 0.36
CYP2D6 P10635 1/20 0.36
MIF P14174 1/20 0.35
TRPA1 O75762 3/20 0.34
HKDC1 Q2TB90 1/20 0.34
AOC3 Q16853 1/20 0.33
HTR2A P28223 1/20 0.33
HRH1 P35367 1/20 0.33
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33
CTSD P07339 1/20 0.33
CTSE P14091 1/20 0.33
BACE1 P56817 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL5853851 1.00 LMNA (0.42) LMNACCR5TAAR1CYP2D6MIF
SCHEMBL5853926 0.85 AOC3 (0.39) LMNACCR5TRPA1AOC3HTR2A
SCHEMBL5853924 0.85 AOC3 (0.39) LMNACCR5TRPA1AOC3HTR2A
SCHEMBL10640638 0.84 LMNA (0.42) LMNACCR5TAAR1CYP2D6MIF
SCHEMBL10640640 0.84 LMNA (0.42) LMNACCR5TAAR1CYP2D6MIF
SCHEMBL1111815 0.83 LMNA (0.45) LMNACCR5TAAR1CYP2D6MIF
SCHEMBL5854697 0.82 POLB (0.39) LMNACYP2D6HTR2ASMN1; SMN2
SCHEMBL5854693 0.82 POLB (0.39) LMNACYP2D6HTR2ASMN1; SMN2
SCHEMBL5852964 0.81 LMNA (0.39) LMNACCR5TAAR1CYP2D6MIF
SCHEMBL5852961 0.81 LMNA (0.39) LMNACCR5TAAR1CYP2D6MIF

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-7037989-B2 Copolymers of ethylene and/or α-olefins and vicinally disubstituted olefins EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-05-02 US disclosed
WO-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed