SCHEMBL3294064

SCHEMBL3294064

CCCCC(CCC)c1cccc(C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAT P00750 1/20 0.46
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
PSEN1 P49768 2/20 0.39
PSEN2 P49810 2/20 0.39
APH1B Q8WW43 2/20 0.39
NCSTN Q92542 2/20 0.39
APH1A Q96BI3 2/20 0.39
PSENEN Q9NZ42 2/20 0.39
CYP19A1 P11511 3/20 0.38
ACHE P22303 1/20 0.38
AOC3 Q16853 1/20 0.37
ACP3 P15309 1/20 0.37
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
FBP1 P09467 1/20 0.35
ALOX5 P09917 1/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 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
SCHEMBL27582981 0.91 PLAT (0.46) PLATPSEN1PSEN2APH1BNCSTN
SCHEMBL20862381 0.91 PLAT (0.44) PLATTAS1R3TAS1R1PSEN1PSEN2
SCHEMBL9439823 0.86 PLAT (0.42) PLATTAS1R3TAS1R1PSEN1PSEN2
SCHEMBL3085828 0.84 NR1I2 (0.49) PLATPSEN1PSEN2APH1BNCSTN
SCHEMBL30862486 0.83 NR1I2 (0.39) PLATALOX5
SCHEMBL8735807 0.81 NOS2 (0.35) PLAT
SCHEMBL22025350 0.81 PLAT (0.36) PLATAOC3
SCHEMBL21142421 0.81 CYP2D6 (0.40) PLATSLC6A2SLC6A4SLC6A3
SCHEMBL21732183 0.81 OPRM1 (0.42) PLATCYP19A1AOC3
SCHEMBL8400500 0.81 HIF1A (0.45) SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723449-B2 Catalysts for synthesizing a polypropylene with a wide molecular weight distribution and use of the same CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) 2010-05-25 US disclosed
US-20090023881-A1 Catalyst for synthesizing a polypropylene with a wide molecular weight distribution and use of the same CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) 2009-01-22 US disclosed