SCHEMBL8900852

SCHEMBL8900852

C=CCC(CC)(C(=O)c1ccc(N2CCOCC2)cc1)N1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.45
MAPT P10636 10/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
LMNA P02545 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ALDH1A1 P00352 7/20 0.41
MAPK1 P28482 4/20 0.41
TSHR P16473 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
POLB P06746 1/20 0.40
ATM Q13315 1/20 0.40
MAOB P27338 1/20 0.40
TP53 P04637 1/20 0.40
PKM P14618 1/20 0.40
KDM4E B2RXH2 4/20 0.40
PTPN1 P18031 1/20 0.40
ESR1 P03372 1/20 0.40
MEN1 O00255 1/20 0.40
RECQL P46063 1/20 0.40

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
SCHEMBL8898225 0.98 GSK3B (0.45) GSK3BMAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL8897338 0.94 GSK3B (0.42) GSK3BMAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL9315455 0.93 GSK3B (0.49) GSK3BMAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL9679470 0.89 GSK3B (0.52) GSK3BMAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL8900168 0.88 NPC1 (0.42) MAPTSMN1; SMN2LMNAL3MBTL1ALDH1A1
SCHEMBL3426330 0.88 ALDH1A1 (0.41) MAPTSMN1; SMN2LMNAALDH1A1MAPK1
SCHEMBL8900208 0.87 GSK3B (0.44) GSK3BMAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL8900214 0.87 GSK3B (0.44) GSK3BMAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL4418400 0.86 ALDH1A1 (0.40) SMN1; SMN2LMNAL3MBTL1ALDH1A1MAPK1
SCHEMBL8899759 0.86 ALDH1A1 (0.60) MAPTSMN1; SMN2LMNAALDH1A1MAPK1

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
US-5698285-A PHOTOCURABLE THREE BOND CO., LTD. (JP) 1997-12-16 US disclosed
US-5629356-A PHOTOCURABLE COMPOSITION CONTAINING ETHYLENICALLY UNSATURATED PHOTOPOLYMERIZABLE COMPOUND AND THE AMINOACETOPHENONE CIBA GEIGY CORPORATION (US) 1997-05-13 US disclosed
US-5554663-A α-aminoacetophenones as photoinitiators CIBA-GEIGY CORPORATION (US) 1996-09-10 US disclosed
US-5534629-A PHOTOPOLYMERIZATION OF PIGMENTED SYSTEMS, INKS CIBA-GEIGY CORPORATION (US) 1996-07-09 US disclosed
EP-0284561-B1 ALPHA-AMINOACETOPHENONES AS PHOTO INITIATORS CIBA-GEIGY AG (CH) 1993-05-12 EP disclosed
US-5077402-A For photocuring pigmented systems; printing inks, lacquers CIBA-GEIGY CORPORATION (US) 1991-12-31 US disclosed
EP-0284561-A2 Alpha-aminoacetophenones as photo initiators CIBA-GEIGY AG (CH) 1988-09-28 EP disclosed