SCHEMBL4450115

SCHEMBL4450115

CCC(C)C(C)CC(c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 3/20 0.47
CHRM2 P08172 2/20 0.47
CHRM1 P11229 2/20 0.47
ADRA1A P35348 2/20 0.47
SLC6A3 Q01959 2/20 0.47
KCNH2 Q12809 2/20 0.47
CACNA1F O60840 1/20 0.47
ADRA2B P18089 1/20 0.47
CHRM3 P20309 1/20 0.47
OPRK1 P41145 1/20 0.47
CACNA1D Q01668 1/20 0.47
CACNA1S Q13698 1/20 0.47
CACNA1C Q13936 1/20 0.47
SCN5A Q14524 1/20 0.47
LMNA P02545 3/20 0.46
TRPA1 O75762 4/20 0.46
TAAR1 Q96RJ0 4/20 0.41
HTR2A P28223 3/20 0.41
KMT2A Q03164 2/20 0.41
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL7761093 0.81 HRH1 (0.50) HRH1CHRM2CHRM1ADRA1ASLC6A3
SCHEMBL5085704 0.79 HRH1 (0.48) HRH1CHRM2CHRM1ADRA1ASLC6A3
SCHEMBL22062330 0.78 TAAR1 (0.41) CHRM2CHRM1CHRM3LMNATRPA1
SCHEMBL27540029 0.77 HRH1 (0.47) HRH1CHRM2CHRM1ADRA1ASLC6A3
SCHEMBL1293117 0.76 LMNA (0.50) HRH1CHRM2CHRM1CHRM3LMNA
SCHEMBL3627329 0.76 LMNA (0.50) HRH1CHRM2CHRM1CHRM3LMNA
SCHEMBL9493121 0.75 HRH1 (0.54) HRH1CHRM2CHRM1ADRA1ASLC6A3
SCHEMBL54346 0.75 HTR2A (0.59) HRH1LMNATRPA1TAAR1HTR2A
SCHEMBL22009966 0.74 HKDC1 (0.52) CHRM2CHRM1ADRA1ASLC6A3LMNA
SCHEMBL18065470 0.74 LMNA (0.48) HRH1CHRM2CHRM1ADRA1ASLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0129479-A1 Modified copolymers from ethylen and at least one alpha-olefin and process for its preparation Société Chimique des Charbonnages S.A. (FR) 1984-12-27 EP claimed
EP-2077289-A1 POLYMERIZABLE COMPOSITION, CROSSLINKABLE RESIN, PROCESS FOR PRODUCING THE SAME, AND USE ZEON CORPORATION (JP) 2009-07-08 EP disclosed
EP-0273274-A2 Degradation of polyethylene by means of agents generating free radicals Elf Atochem Deutschland GmbH (DE) 1988-07-06 EP disclosed
EP-0129479-A1 Modified copolymers from ethylen and at least one alpha-olefin and process for its preparation Société Chimique des Charbonnages S.A. (FR) 1984-12-27 EP disclosed
US-4027080-A Crosslinking of polyolefines PEROXID-CHEMIE GMBH (DT) 1977-05-31 US disclosed