SCHEMBL570699

SCHEMBL570699

C=CCN(CC=C)C(=O)CCC

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.68
SMN1; SMN2 Q16637 1/20 0.42
LMNA P02545 2/20 0.39
MAPT P10636 1/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.38
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
FFAR3 O14843 2/20 0.35
HDAC3 O15379 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC2 Q92769 2/20 0.35
HDAC8 Q9BY41 2/20 0.35
RAB9A P51151 1/20 0.35
DPP4 P27487 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TSHR P16473 2/20 0.33
FAAH O00519 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
SCHEMBL9806982 0.91 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2LMNAMAPTPOLB
SCHEMBL16350574 0.85 ALDH1A1 (0.81) ALDH1A1SMN1; SMN2LMNAMAPTPOLB
SCHEMBL568962 0.85 ALDH1A1 (0.73) ALDH1A1LMNACES2CES1MEN1
SCHEMBL4245319 0.84 ALDH1A1 (0.70) ALDH1A1LMNACES2CES1MEN1
SCHEMBL570411 0.84 ALDH1A1 (0.70) ALDH1A1LMNACES2CES1MEN1
SCHEMBL4019233 0.84 ALDH1A1 (0.70) ALDH1A1LMNACES2CES1MEN1
SCHEMBL11564777 0.84 ALDH1A1 (0.70) ALDH1A1LMNACES2CES1MEN1
SCHEMBL4243964 0.84 ALDH1A1 (0.70) ALDH1A1LMNACES2CES1MEN1
SCHEMBL30763455 0.84 ALDH1A1 (0.70) ALDH1A1LMNACES2CES1MEN1
SCHEMBL30763459 0.84 ALDH1A1 (0.70) ALDH1A1LMNACES2CES1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150279504-A1 FILM FORMING COMPOSITION COMPRISING GRAPHENE MATERIAL AND CONDUCTING POLYMER SOLVAY (BE) 2015-10-01 US disclosed
EP-2601047-A1 METHODS OF COATING A LOW SURFACE ENERGY SUBSTRATE Novel Polymer Solutions Limited (GB) 2013-06-12 EP disclosed
WO-2012017233-A1 METHODS OF COATING A LOW SURFACE ENERGY SUBSTRATE NOVEL POLYMER SOLUTIONS LIMITED (GB) 2012-02-09 WO disclosed