SCHEMBL3675485

SCHEMBL3675485

CCCCC(C#N)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.42
DNM1 Q05193 2/20 0.35
OPRM1 P35372 1/20 0.33
CA2 P00918 1/20 0.33
MAPK1 P28482 1/20 0.33
ALDH1A1 P00352 3/20 0.31
TDP1 Q9NUW8 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
CYP3A4 P08684 1/20 0.30
FDPS P14324 1/20 0.30

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
SCHEMBL364354 0.84
SCHEMBL91254 0.83 TSHR (0.40) TSHRDNM1OPRM1CA2MAPK1
SCHEMBL22810400 0.81 TSHR (0.39) TSHRDNM1OPRM1CA2MAPK1
SCHEMBL27978858 0.81 OPRM1 (0.41) TSHRDNM1OPRM1CA2MAPK1
SCHEMBL13129918 0.81 TSHR (0.39) TSHRDNM1OPRM1CA2MAPK1
SCHEMBL11506838 0.80 TSHR (0.48) TSHRALDH1A1TDP1
SCHEMBL20758509 0.80 LMNA (0.42) TSHRMAPK1
SCHEMBL20822187 0.79 OPRM1 (0.39) TSHRDNM1OPRM1CA2
SCHEMBL10987090 0.79 TSHR (0.46) TSHRDNM1OPRM1FDPS
SCHEMBL12475428 0.77 DNM1 (0.36) TSHRDNM1OPRM1CA2MAPK1

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-7714087-B2 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof MITSUI CHEMICALS, INC. (JP) 2010-05-11 US disclosed
US-20090137757-A1 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof IMUTA JUNICHI 2009-05-28 US disclosed