SCHEMBL6451735

SCHEMBL6451735

CC(=CCCN1CCCC1)C(N)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 5/20 0.38
MAPT P10636 3/20 0.38
POLB P06746 1/20 0.38
CYP1A2 P05177 2/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPC1 O15118 1/20 0.36
TSHR P16473 2/20 0.34
ALOX15 P16050 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
HTT P42858 1/20 0.33
CARM1 Q86X55 1/20 0.32
PRMT6 Q96LA8 1/20 0.32
PRMT8 Q9NR22 1/20 0.32
CYP2D6 P10635 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
SCHEMBL30361826 0.98 L3MBTL1 (0.48) L3MBTL1ALDH1A1MAPTPOLBCYP1A2
SCHEMBL6913912 0.98 L3MBTL1 (0.48) L3MBTL1ALDH1A1MAPTPOLBCYP1A2
SCHEMBL6449843 0.84 GAA (0.46) ALDH1A1MAPTLMNAMAPK1SMN1; SMN2
SCHEMBL1275570 0.83 CYP1A2 (0.41) L3MBTL1ALDH1A1MAPTPOLBCYP1A2
SCHEMBL1275573 0.83 CYP1A2 (0.41) L3MBTL1ALDH1A1MAPTPOLBCYP1A2
SCHEMBL489033 0.81 CYP1A2 (0.44) L3MBTL1ALDH1A1MAPTPOLBCYP1A2
SCHEMBL7113045 0.79 ALDH1A1 (0.36) L3MBTL1ALDH1A1MAPTPOLBCYP1A2
SCHEMBL17983458 0.75 GAA (0.51) ALDH1A1MAPTLMNAMAPK1SMN1; SMN2
SCHEMBL528543 0.75 LMNA (0.39) POLBLMNAMAPK1ALOX15
SCHEMBL528542 0.75 LMNA (0.39) POLBLMNAMAPK1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1504044-A2 CORE-SHELL POLYMERIC COMPOSITIONS MEADWESTVACO CORPORATION, Law Department (US) 2005-02-09 EP claimed
US-6767638-B2 Core-shell polymeric compositions MEADWESTVACO CORPORATION 2004-07-27 US claimed
WO-2003097709-A2 CORE-SHELL POLYMERIC COMPOSITIONS MEADWESTVACO CORPORATION (US) 2003-11-27 WO claimed
US-20030215604-A1 Core-shell polymeric compositions WESTVACO CORPORATION (US) 2003-11-20 US claimed
EP-1504044-A2 CORE-SHELL POLYMERIC COMPOSITIONS MEADWESTVACO CORPORATION, Law Department (US) 2005-02-09 EP disclosed
US-6767638-B2 Core-shell polymeric compositions MEADWESTVACO CORPORATION 2004-07-27 US disclosed
WO-2003097709-A2 CORE-SHELL POLYMERIC COMPOSITIONS MEADWESTVACO CORPORATION (US) 2003-11-27 WO disclosed
US-20030215604-A1 Core-shell polymeric compositions WESTVACO CORPORATION (US) 2003-11-20 US disclosed