SCHEMBL1929136

SCHEMBL1929136

C=CCC1(CC=C)c2ccccc2C(C)(C)c2ccccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.37
PGR P06401 2/20 0.37
MLNR O43193 1/20 0.35
NR1I2 O75469 1/20 0.35
CHRM2 P08172 1/20 0.35
ADRB1 P08588 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
CHRM1 P11229 1/20 0.35
DRD2 P14416 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
CHRM3 P20309 1/20 0.35
DRD1 P21728 1/20 0.35
SLC6A2 P23975 1/20 0.35
HTR2C P28335 1/20 0.35
SLC6A4 P31645 1/20 0.35
ADRA1A P35348 1/20 0.35
HRH1 P35367 1/20 0.35
OPRM1 P35372 1/20 0.35

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
SCHEMBL88451 0.78 PGR (0.49) PGRADRA1AKCNH2KMT2ACYP1A2
SCHEMBL30511096 0.78 PGR (0.49) PGRADRA1AKCNH2KMT2ACYP1A2
SCHEMBL28969992 0.75 PGR (0.37) PGRSLC6A2HTR2CKMT2ACYP1A2
Alcohol SCHEMBL28871387 0.75 PGR (0.43) PGRKMT2ACYP1A2CYP2D6PDK2
SCHEMBL29392540 0.74 HTR2A (0.48) HTR2APGRMLNRNR1I2CHRM2
SCHEMBL1627657 0.74 HTR2A (0.48) HTR2APGRMLNRNR1I2CHRM2
SCHEMBL11391184 0.73 PGR (0.36) PGRCHRM3KMT2AMEN1ALDH1A1
SCHEMBL7597606 0.72 PGR (0.41) HTR2APGRMLNRNR1I2CHRM2
SCHEMBL2594088 0.72 PGR (0.51) PGRADRA1AKCNH2KMT2ACYP1A2
SCHEMBL1929330 0.72 PGR (0.42) PGRPDK2

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
CN-101255214-B Diene polymer and process for producing the same SUMITOMO CO LTD 2013-01-02 CN disclosed
US-7956145-B2 Polymerization of 1,6-heptadiene in the presence of a catalyst formed by contacting a transition metal with a diimino aluminum or boron compound, giving a polymer structure of alternating ethylene and cyclopentene; superior balance between a heat resistance and workability SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-07 US disclosed
US-20080234450-A1 DIENE POLYMER AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-25 US disclosed