SCHEMBL5619620

SCHEMBL5619620

[CH2]C#CCC(=O)N(CC=C)CC=C

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
DPP4 P27487 1/20 0.33
MAPT P10636 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL7833501 0.74 LMNA (0.44) ALDH1A1KDM4E
SCHEMBL362773 0.72 ALDH1A1 (0.65) ALDH1A1POLBSMN1; SMN2DPP4MAPT
SCHEMBL16350574 0.72 ALDH1A1 (0.81) ALDH1A1POLBSMN1; SMN2DPP4MAPT
SCHEMBL3305715 0.70 ALDH1A1 (0.62) ALDH1A1POLBSMN1; SMN2DPP4MAPT
SCHEMBL6160109 0.70 ALDH1A1 (0.62) ALDH1A1POLBSMN1; SMN2DPP4MAPT
SCHEMBL5485685 0.70 ALDH1A1 (0.62) ALDH1A1POLBSMN1; SMN2DPP4MAPT
SCHEMBL6160104 0.70 ALDH1A1 (0.62) ALDH1A1POLBSMN1; SMN2DPP4MAPT
N,N-Diallyl-2-Chloroacetamide SCHEMBL4886939 0.69 ALDH1A1 (0.60) ALDH1A1POLBSMN1; SMN2DPP4MAPT
SCHEMBL8068413 0.69 ALDH1A1 (0.91) ALDH1A1POLBSMN1; SMN2DPP4MAPT
SCHEMBL9816041 0.69 ALDH1A1 (0.60) ALDH1A1POLBSMN1; SMN2DPP4MAPT

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
EP-1781311-A2 GROWTH-HORMONE SECRETAGOGUES Elixir Pharmaceuticals, Inc. (US) 2007-05-09 EP disclosed
WO-2006023608-A2 GROWTH-HORMONE SECRETAGOGUES ELIXIR PHARMACEUTICALS, INC. (US) 2006-03-02 WO disclosed
EP-1105376-A1 OXINDOLE DERIVATIVES AS GROWTH HORMONE RELEASERS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2001-06-13 EP disclosed
WO-2000010975-A1 OXINDOLE DERIVATIVES AS GROWTH HORMONE RELEASERS SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 2000-03-02 WO disclosed