SCHEMBL4855321

SCHEMBL4855321

CC/C(N)=C(\CC)C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.35
FFAR3 O14843 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ALOX15 P16050 2/20 0.33
LMNA P02545 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
LDHA P00338 1/20 0.30
LDHB P07195 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
SCHEMBL3357443 1.00 TDP1 (0.35) TDP1FFAR3ALDH1A1ALOX15LMNA
SCHEMBL1831176 0.84 TDP1 (0.41) TDP1FFAR3ALDH1A1ALOX15LMNA
SCHEMBL8688580 0.84 TDP1 (0.41) TDP1FFAR3ALDH1A1ALOX15LMNA
SCHEMBL1831174 0.84 TDP1 (0.41) TDP1FFAR3ALDH1A1ALOX15LMNA
SCHEMBL3357465 0.81 ALDH1A1 (0.40) TDP1FFAR3ALDH1A1
SCHEMBL4861546 0.81 ALDH1A1 (0.40) TDP1FFAR3ALDH1A1
SCHEMBL2636263 0.80 GRIK1 (0.40) TDP1FFAR3ALDH1A1ALOX15LMNA
SCHEMBL5596730 0.80 GRIK1 (0.40) TDP1FFAR3ALDH1A1ALOX15LMNA
SCHEMBL5253704 0.79
SCHEMBL8081484 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0249857-A2 Photosensitive registration element BASF Aktiengesellschaft (DE) 1987-12-23 EP claimed
US-7442244-B2 Water-base ink composition SEIKO EPSON CORPORATION (JP) 2008-10-28 US disclosed
EP-1688465-A1 WATER-BASED INK COMPOSITION AND METHOD OF INK-JET RECORDING WITH THE SAME SEIKO EPSON CORPORATION (JP) 2006-08-09 EP disclosed
US-20050235870-A1 2-ethyl-1,3-hexanediol, acetylene glycol surfactant and/or penetrating organic solvent, and humectant; ink jet printing; highly stably ejected and evenly printed on recording media; clogged nozzle problem prevented SEIKO EPSON CORPORATION 2005-10-27 US disclosed
US-6877851-B2 Ink set for ink jet recording, ink jet recording process, and recorded matter SEIKO EPSON CORPORATION (JP) 2005-04-12 US disclosed
US-20040239738-A1 Ink set for ink jet recording, ink jet recording process, and recorded matter SEIKO EPSON CORPORATION 2004-12-02 US disclosed
EP-0118327-B1 CATIONIC LATICES FROM CONJUGATED DIENES RHONE-POULENC CHIMIE (FR) 1987-04-22 EP disclosed