SCHEMBL7055729

SCHEMBL7055729

C=CCCC/C=C/CC(=C)C

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.39
ALDH1A1 P00352 3/20 0.39
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
USP2 O75604 1/20 0.35
CYP3A4 P08684 1/20 0.35
RECQL P46063 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CNR1 P21554 1/20 0.33
TRPA1 O75762 2/20 0.31
ABCC4 O15439 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
SCHEMBL7055732 1.00 TSHR (0.39) TSHRALDH1A1LMNAMAPTUSP2
SCHEMBL1565944 0.87 ALDH1A1 (0.36) TSHRALDH1A1LMNAMAPTUSP2
SCHEMBL1565942 0.83 TSHR (0.43) TSHRALDH1A1LMNAMAPTUSP2
SCHEMBL10839949 0.79 KMT2A (0.42) TSHRALDH1A1LMNAMAPTUSP2
SCHEMBL11129558 0.79 KMT2A (0.42) TSHRALDH1A1LMNAMAPTUSP2
SCHEMBL7198282 0.78 TSHR (0.46) TSHRALDH1A1LMNAMAPTUSP2
SCHEMBL6731505 0.77 ALDH1A1 (0.50) TSHRALDH1A1LMNAMAPTUSP2
SCHEMBL6731503 0.77 ALDH1A1 (0.50) TSHRALDH1A1LMNAMAPTUSP2
SCHEMBL6720512 0.77 ALDH1A1 (0.50) TSHRALDH1A1LMNAMAPTUSP2
SCHEMBL6720513 0.77 ALDH1A1 (0.50) TSHRALDH1A1LMNAMAPTUSP2

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
EP-1406852-A2 METHOD FOR TELOMERIZING NON-CYCLIC OLEFINS Oxeno Olefinchemie GmbH (DE) 2004-04-14 EP disclosed
WO-2002100803-A2 METHOD FOR TELOMERIZING NON-CYCLIC OLEFINS OXENO OLEFINCHEMIE GMBH (DE) 2002-12-19 WO disclosed