SCHEMBL8778093

SCHEMBL8778093

CCCCCCCCOC(=O)c1ccc[n+]([O-])c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
ALDH1A1 P00352 3/20 0.54
TSHR P16473 2/20 0.54
MAPT P10636 3/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
TP53 P04637 1/20 0.51
CYP3A4 P08684 1/20 0.51
MAPK1 P28482 1/20 0.51
STS P08842 5/20 0.50
ESR1 P03372 3/20 0.50
AKR1C4 P17516 1/20 0.50
AKR1C3 P42330 1/20 0.50
AKR1C2 P52895 1/20 0.50
AKR1C1 Q04828 1/20 0.50
MEN1 O00255 1/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL8778119 1.00 LMNA (0.56) LMNAALDH1A1TSHRMAPTNPC1
SCHEMBL9172557 1.00 LMNA (0.56) LMNAALDH1A1TSHRMAPTNPC1
SCHEMBL9321388 1.00 LMNA (0.56) LMNAALDH1A1TSHRMAPTNPC1
SCHEMBL8728841 0.99 LMNA (0.53) LMNAALDH1A1TSHRMAPTNPC1
SCHEMBL14107746 0.88 LMNA (0.60) LMNAALDH1A1TSHRMAPTSTS
SCHEMBL10257278 0.84 LMNA (0.57) LMNAALDH1A1TSHRMAPTNPC1
SCHEMBL26184983 0.82 LMNA (0.61) LMNAALDH1A1TSHRMAPTNPC1
SCHEMBL4862698 0.82 GLA (0.57) LMNAALDH1A1TSHRMAPTCYP3A4
Bromide SCHEMBL7623772 0.81 LMNA (0.63) LMNAALDH1A1TSHRMAPTNPC1
SCHEMBL4762178 0.81 ALDH1A1 (0.45) LMNAALDH1A1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0576622-B1 LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK CO (US) 1997-11-05 EP claimed
EP-0576622-A1 LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK COMPANY (US) 1994-01-05 EP claimed
WO-1992017821-A1 LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK COMPANY (US) 1992-10-15 WO claimed
US-5141839-A LITHOGRAPHIC PRINTING PLATES HAVING A RADIATION-SENSITIVE LAYER COMPRISING A PHOTOCROSSLINKABLE POLYMER, A LEUCO DYE, A PHOTOOXIDANT AND A HETEROAROMATIC AMINE N-OXIDE EASTMAN KODAK COMPANY (US) 1992-08-25 US claimed
US-5141842-A Negative working lithography printing plates EASTMAN KODAK COMPANY (US) 1992-08-25 US claimed
EP-0576622-B1 LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK CO (US) 1997-11-05 EP disclosed
EP-0576622-A1 LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK COMPANY (US) 1994-01-05 EP disclosed
WO-1992017821-A1 LITHOGRAPHIC PRINTING PLATES EASTMAN KODAK COMPANY (US) 1992-10-15 WO disclosed
US-5141839-A LITHOGRAPHIC PRINTING PLATES HAVING A RADIATION-SENSITIVE LAYER COMPRISING A PHOTOCROSSLINKABLE POLYMER, A LEUCO DYE, A PHOTOOXIDANT AND A HETEROAROMATIC AMINE N-OXIDE EASTMAN KODAK COMPANY (US) 1992-08-25 US disclosed
US-5141842-A Negative working lithography printing plates EASTMAN KODAK COMPANY (US) 1992-08-25 US disclosed