SCHEMBL5165238

SCHEMBL5165238

N#CC(CCCc1ccccc1)OC(=O)/C=C/c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B10 O60218 6/20 0.52
AKR1B1 P15121 6/20 0.52
LMNA P02545 2/20 0.48
MAOB P27338 1/20 0.45
ALDH1A1 P00352 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
MAPK1 P28482 1/20 0.44
CYP2C19 P33261 1/20 0.44
MMP1 P03956 2/20 0.43
POLB P06746 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
RECQL P46063 1/20 0.43
CA12 O43570 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42

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
SCHEMBL10424830 0.84 LMNA (0.52) AKR1B10AKR1B1LMNAMAOBALDH1A1
SCHEMBL10424829 0.84 LMNA (0.52) AKR1B10AKR1B1LMNAMAOBALDH1A1
SCHEMBL28643098 0.83 KMT2A (0.48) AKR1B10AKR1B1LMNAMAOBALDH1A1
SCHEMBL11303515 0.79 TDP1 (0.45) MAPK1MMP1POLBMMP2MMP9
SCHEMBL2454845 0.75 TDP1 (0.44) MAPK1KMT2A
SCHEMBL8662418 0.74 TRPA1 (0.45) KMT2A
SCHEMBL5007751 0.73 AKR1B10 (0.50) AKR1B10AKR1B1LMNAALDH1A1CYP1A2
SCHEMBL5007756 0.73 AKR1B10 (0.50) AKR1B10AKR1B1LMNAALDH1A1CYP1A2
SCHEMBL3249348 0.73 AKR1B10 (0.84) AKR1B10AKR1B1LMNAMAOBALDH1A1
SCHEMBL1532425 0.73 AKR1B10 (0.84) AKR1B10AKR1B1LMNAMAOBALDH1A1

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
EP-1270248-B1 Sheet for ink jet recording FUJIFILM CORP (JP) 2007-03-21 EP disclosed
US-20030026960-A1 Sheet for ink jet recording FUJI PHOTO FILM CO., LTD. 2003-02-06 US disclosed
EP-1270248-A2 Sheet for ink jet recording FUJI PHOTO FILM CO., LTD. (JP) 2003-01-02 EP disclosed