SCHEMBL9633072

SCHEMBL9633072

CCN(CC)c1ccc(C=C2CN(C)CC(=Cc3ccc(N(CC)CC)cc3OC)C2=O)c(OC)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
NFE2L2 Q16236 1/20 0.56
CYBB P04839 2/20 0.52
NOX4 Q9NPH5 2/20 0.52
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
MAPT P10636 2/20 0.51
KDM4E B2RXH2 1/20 0.51
LMNA P02545 1/20 0.51
GAA P10253 2/20 0.50
PAX8 Q06710 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
LY96 Q9Y6Y9 1/20 0.49
PTGS2 P35354 2/20 0.47
ACHE P22303 2/20 0.47
CES2 O00748 1/20 0.43
EGFR P00533 1/20 0.43
PTK2 Q05397 1/20 0.43

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
SCHEMBL9632451 0.85 ALDH1A1 (0.60) ALDH1A1L3MBTL1NFE2L2CYBBNOX4
SCHEMBL9632830 0.85 ALDH1A1 (0.60) ALDH1A1L3MBTL1NFE2L2CYBBNOX4
SCHEMBL9631620 0.84 ALDH1A1 (0.59) ALDH1A1L3MBTL1NFE2L2CYBBNOX4
SCHEMBL9633148 0.84 PTGS2 (0.50) ALDH1A1L3MBTL1NFE2L2MEN1KMT2A
SCHEMBL8780603 0.82 ACHE (0.49) ALDH1A1L3MBTL1NFE2L2MEN1KMT2A
SCHEMBL30298456 0.77 MEN1 (0.65) ALDH1A1L3MBTL1CYBBNOX4MEN1
SCHEMBL10478061 0.77 MEN1 (0.65) ALDH1A1L3MBTL1CYBBNOX4MEN1
SCHEMBL2203151 0.76 ACHE (0.57) ALDH1A1MEN1KMT2AMAPTKDM4E
SCHEMBL2203150 0.76 ACHE (0.57) ALDH1A1MEN1KMT2AMAPTKDM4E
SCHEMBL17899561 0.74 ACHE (0.65) ALDH1A1L3MBTL1NFE2L2MEN1KMT2A

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-0295044-B1 PHOTOINITIATOR AND PHOTOPOLYMERIZABLE COMPOSITION USING THE SAME Hitachi Chemical Co., Ltd. (JP) 1992-04-22 EP disclosed
US-4987057-A HIGH SENSITIVITY TO VISIBLE LIGHT RAYS HITACHI CHEMICAL CO., LTD. (JP) 1991-01-22 US disclosed
EP-0295044-A2 Photoinitiator and photopolymerizable composition using the same Hitachi Chemical Co., Ltd. (JP) 1988-12-14 EP disclosed