SCHEMBL6062402

SCHEMBL6062402

C=CCCCCCCCC1OCCO1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
ABCC4 O15439 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 5/20 0.34
LPAR3 Q9UBY5 2/20 0.34
LMNA P02545 2/20 0.34
LPAR2 Q9HBW0 1/20 0.34
SLC2A1 P11166 1/20 0.33
TRPA1 O75762 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
USP2 O75604 1/20 0.32
HPGD P15428 1/20 0.32
FAAH O00519 1/20 0.31

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
SCHEMBL8643000 1.00 TSHR (0.39) TSHRABCC4MAPTALDH1A1LPAR3
SCHEMBL20337904 1.00 TSHR (0.39) TSHRABCC4MAPTALDH1A1LPAR3
SCHEMBL20337844 0.98 TSHR (0.36) TSHRABCC4MAPTALDH1A1LPAR3
SCHEMBL20337956 0.91 FAAH (0.36) TSHRABCC4MAPTALDH1A1TDP1
SCHEMBL10510441 0.83 FAAH (0.34) TSHRABCC4MAPTALDH1A1FAAH
SCHEMBL17847327 0.81
SCHEMBL31053642 0.81
SCHEMBL7795606 0.81 ALDH1A1 (0.42) ALDH1A1
SCHEMBL3807307 0.81 ALDH1A1 (0.42) ALDH1A1
SCHEMBL1495306 0.80 ALDH1A1 (0.52) TSHRABCC4MAPTALDH1A1LPAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006009942-A1 POLYMERIZATION PROCESS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-01-26 WO disclosed