SCHEMBL6573272

SCHEMBL6573272

C=CCCCCCCCCCCCC=CC

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.55
MAPT P10636 2/20 0.46
ABCC4 O15439 1/20 0.46
ALDH1A1 P00352 3/20 0.46
LMNA P02545 2/20 0.45
USP2 O75604 1/20 0.43
CYP3A4 P08684 1/20 0.43
RECQL P46063 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TRPA1 O75762 2/20 0.38
LPAR3 Q9UBY5 2/20 0.35
LPAR2 Q9HBW0 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
SCHEMBL6668480 1.00 TSHR (0.55) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL1521429 1.00 TSHR (0.55) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL1521428 1.00 TSHR (0.55) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL669112 1.00 TSHR (0.55) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL15620243 1.00 TSHR (0.55) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL1521286 1.00 TSHR (0.55) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL10630524 1.00 TSHR (0.55) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL21219314 1.00 TSHR (0.55) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL21219349 1.00 TSHR (0.55) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL5980998 1.00 TSHR (0.55) TSHRMAPTABCC4ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023085299-A1 CATIONIC LIPID 武田薬品工業株式会社 2023-05-19 WO disclosed
EP-1397396-A2 POLYPROPYLENE RESIN COMPOSITION Basell Poliolefine Italia S.p.A. (IT) 2004-03-17 EP disclosed
EP-1397432-A2 POLYPROPYLENE RESIN COMPOSITION Basell Poliolefine Italia S.p.A. (IT) 2004-03-17 EP disclosed
WO-2002096986-A2 POLYPROPYLENE RESIN COMPOSITION BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2002-12-05 WO disclosed
WO-2002096960-A2 POLYPROPYLENE RESIN COMPOSITION BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2002-12-05 WO disclosed