SCHEMBL16658922

SCHEMBL16658922

CC(C)CCCCCCn1c(=O)n(CCCCCCC(C)C)c(=O)n(CCCCCCC(C)C)c1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.37
▸ RGS4 P49798 1/20 0.37
▸ RGS8 P57771 1/20 0.37
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ CNOT7 Q9UIV1 1/20 0.35
▸ ADORA2B P29275 2/20 0.34
▸ PDE2A O00408 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ PDE1A P54750 1/20 0.34
▸ PDE1B Q01064 1/20 0.34
▸ PDE1C Q14123 1/20 0.34
▸ SORT1 Q99523 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ DAO P14920 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
SCHEMBL23509686 0.92 RGS4 (0.44) LMNAALDH1A1RGS4RGS8ADORA2B
SCHEMBL16658929 0.92 RGS4 (0.44) LMNAALDH1A1RGS4RGS8MAOA
SCHEMBL22711577 0.86 CYP3A4 (0.53) ALDH1A1MAOAMAOBADORA2BADORA2A
SCHEMBL24999154 0.83 — —
SCHEMBL23509687 0.82 MAOA (0.36) MAOAMAOB
SCHEMBL14802479 0.80 ALDH1A1 (0.52) LMNAALDH1A1ADORA2BPDE2AADORA2A
SCHEMBL25283306 0.80 RGS4 (0.34) RGS4RGS8
SCHEMBL19493728 0.79 CYP3A4 (0.50) ALDH1A1MAOAMAOBADORA2BADORA2A
SCHEMBL18053449 0.77 CYP3A4 (0.57) ALDH1A1CNOT7ADORA2BADORA2ANPSR1
SCHEMBL19754406 0.75 SMN1; SMN2 (0.43) LMNAALDH1A1RGS4RGS8ADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150111978-A1 METHOD OF FORMING DUAL CURABLE POLYMER COMPOSITIONS NIPSEA TECHNOLOGIES PTE LTD (SG) 2015-04-23 — — US disclosed
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