SCHEMBL3687650

SCHEMBL3687650

C=CCN(C(=O)CCCCCC)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.53
NPC1 O15118 1/20 0.52
JAK2 O60674 1/20 0.52
RAB9A P51151 1/20 0.52
PAX8 Q06710 1/20 0.52
LTB4R2 Q9NPC1 9/20 0.49
AGTR1 P30556 1/20 0.45
TSHR P16473 2/20 0.45
CES2 O00748 2/20 0.44
CES1 P23141 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 1/20 0.42
GLA P06280 1/20 0.42

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
SCHEMBL28469980 1.00 TP53 (0.53) TP53NPC1JAK2RAB9APAX8
SCHEMBL17439411 0.83 TP53 (0.60) TP53NPC1JAK2RAB9APAX8
SCHEMBL11518360 0.83 TP53 (0.60) TP53NPC1JAK2RAB9APAX8
SCHEMBL29266757 0.82 NPC1 (0.75) TP53NPC1JAK2RAB9APAX8
SCHEMBL4207496 0.82 TSHR (0.51) TP53NPC1RAB9ALTB4R2TSHR
SCHEMBL4062526 0.81 TP53 (0.57) TP53NPC1JAK2RAB9APAX8
SCHEMBL9666989 0.81 TP53 (0.57) TP53NPC1JAK2RAB9APAX8
SCHEMBL9664702 0.81 TP53 (0.57) TP53NPC1JAK2RAB9APAX8
SCHEMBL9664195 0.81 TP53 (0.57) TP53NPC1JAK2RAB9APAX8
SCHEMBL4743986 0.81 TP53 (0.57) TP53NPC1JAK2RAB9APAX8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240240062-A1 (METH)ACRYLATE-BASED TWO-PART ADHESIVE COMPOSITION HENKEL AG & CO KGAA (DE) 2024-07-18 US disclosed
CN-118043422-A Two-part adhesive compositions based on (meth) acrylic esters 汉高股份有限及两合公司 2024-05-14 CN disclosed
WO-2023050111-A1 (METH) ACRYLATE-BASED TWO-PART ADHESIVE COMPOSITION HENKEL AG & CO. KGAA (DE) 2023-04-06 WO disclosed
US-7674838-B2 Curable foam elastomeric compositions HENKEL CORPORATION (US) 2010-03-09 US disclosed
US-20060014844-A1 Curable foam elasomeric compositions HENKEL LOCTITE CORPORATION 2006-01-19 US disclosed
WO-2003087204-A9 CURABLE FOAM ELASTOMERIC COMPOSITIONS HENKEL CORP (US) 2004-02-26 WO disclosed
WO-2003087204-A1 CURABLE FOAM ELASTOMERIC COMPOSITIONS HENKEL CORPORATION (US) 2003-10-23 WO disclosed