SCHEMBL6287769

SCHEMBL6287769

CCCCNCC(CC)(CNCCCC)COC(N)=O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
HSD17B10 Q99714 1/20 0.42
TSHR P16473 3/20 0.36
CYP3A4 P08684 1/20 0.36
NFKB1 P19838 1/20 0.36
ADRA1A P35348 1/20 0.36
RAB9A P51151 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ACHE P22303 12/20 0.36
ALOX15 P16050 2/20 0.35
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GAA P10253 1/20 0.32

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
SCHEMBL5247594 0.93 LMNA (0.44) LMNAHSD17B10TSHRCYP3A4NFKB1
SCHEMBL6280238 0.83 LMNA (0.43) LMNAHSD17B10TSHRCYP3A4NFKB1
SCHEMBL5244778 0.83 EPHX1 (0.45) TSHRNFKB1ACHEPOLBSMN1; SMN2
SCHEMBL5245027 0.83 ACHE (0.54) ACHEALOX15GAA
SCHEMBL6287636 0.82 LMNA (0.56) LMNAHSD17B10TSHRCYP3A4NFKB1
SCHEMBL6290258 0.82 LMNA (0.47) LMNAHSD17B10TSHRCYP3A4NFKB1
SCHEMBL5246483 0.81 ACHE (0.45) TSHRACHEALOX15
SCHEMBL5244908 0.78 LMNA (0.44) LMNAHSD17B10TSHRCYP3A4NFKB1
SCHEMBL6287064 0.77 EPHX1 (0.36) TSHRACHEALOX15POLBSMN1; SMN2
SCHEMBL20104322 0.76 LMNA (0.54) LMNAHSD17B10TSHRCYP3A4NFKB1

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
US-6916854-B2 Heat and/or light curable films or coatings comprising polyurethanes or polyureaurethane copolymers having storage stability, used as automobile paints BASF AKTIENGESELLSCHAFT (DE) 2005-07-12 US disclosed
US-20040097642-A1 Unsaturated compounds containing carbamate terminal groups or urea terminal groups BASF AKTIENGESELLSCHAFT (DE) 2004-05-20 US disclosed