SCHEMBL8665131

SCHEMBL8665131

CCCCCNN1CCN(NCCCCC)CC1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.67
GNAO1 P09471 1/20 0.67
GNAI1 P63096 1/20 0.67
TSHR P16473 2/20 0.46
ALDH1A1 P00352 1/20 0.46
EPHX1 P07099 7/20 0.42
ADH1B P00325 2/20 0.37
ADH1C P00326 2/20 0.37
ADH1A P07327 2/20 0.37
ADH7 P40394 2/20 0.37
ADH4 P08319 1/20 0.37
THRB P10828 1/20 0.35
CYP4Z1 Q86W10 4/20 0.33
PPARA Q07869 1/20 0.33

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
SCHEMBL28627512 0.97 GNAI3 (0.70) GNAI3GNAO1GNAI1TSHRALDH1A1
SCHEMBL28300170 0.97 GNAI3 (0.70) GNAI3GNAO1GNAI1TSHRALDH1A1
SCHEMBL28632179 0.97 GNAI3 (0.70) GNAI3GNAO1GNAI1TSHRALDH1A1
SCHEMBL28641324 0.97 GNAI3 (0.70) GNAI3GNAO1GNAI1TSHRALDH1A1
SCHEMBL8412464 0.97 GNAI3 (0.70) GNAI3GNAO1GNAI1TSHRALDH1A1
SCHEMBL19503494 0.91 GNAI3 (0.58) GNAI3GNAO1GNAI1TSHRALDH1A1
SCHEMBL17107331 0.90 GNAI3 (0.62) GNAI3GNAO1GNAI1TSHRALDH1A1
Hydrochloric Acid SCHEMBL11550862 0.90 GNAI3 (0.61) GNAI3GNAO1GNAI1TSHRALDH1A1
SCHEMBL9598276 0.88 GNAI3 (0.66) GNAI3GNAO1GNAI1TSHRALDH1A1
SCHEMBL8408732 0.88 GNAI3 (0.66) GNAI3GNAO1GNAI1TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998009994-A1 ADHESIVES FOR FLEXIBLE LAMINATES HENKEL CORPORATION (US) 1998-03-12 WO disclosed
EP-0775172-A4 AQUEOUS COMPOSITIONS CONTAINING POLYMERIZABLE SURFACTANT COMPOUNDS HENKEL CORP (US) 1997-09-24 EP disclosed
EP-0775172-A1 AQUEOUS COMPOSITIONS CONTAINING POLYMERIZABLE SURFACTANT COMPOUNDS HENKEL CORPORATION (US) 1997-05-28 EP disclosed
WO-1996005251-A1 AQUEOUS COMPOSITIONS CONTAINING POLYMERIZABLE SURFACTANT COMPOUNDS HENKEL CORPORATION (US) 1996-02-22 WO disclosed