SCHEMBL10685484

SCHEMBL10685484

C/C(=C/C(=O)O)C(=O)O.C/C(=C/C(=O)O)C(=O)O.[Cu]

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.43
PTGS1 P23219 1/20 0.42
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 4/20 0.37
MAPT P10636 3/20 0.37
POLB P06746 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ALDH1A1 P00352 1/20 0.37
PKM P14618 1/20 0.37
AKR1C3 P42330 1/20 0.37
CYP2C9 P11712 1/20 0.36
TSHR P16473 2/20 0.36
ATM Q13315 1/20 0.36
FFAR3 O14843 1/20 0.35
LCK P06239 1/20 0.35
FYN P06241 1/20 0.35

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
SCHEMBL5893 0.97
SCHEMBL28517 0.97
SCHEMBL6040109 0.97 HTT (0.45) HTTPTGS1KMT2AKDM4EMAPT
SCHEMBL5894 0.97
SCHEMBL623108 0.97 HTT (0.45) HTTPTGS1KMT2AKDM4EMAPT
SCHEMBL623803 0.97 HTT (0.45) HTTPTGS1KMT2AKDM4EMAPT
SCHEMBL27531633 0.97 HTT (0.45) HTTPTGS1KMT2AKDM4EMAPT
Ammonia Solution, Strong SCHEMBL16423856 0.94 HTT (0.43) HTTPTGS1KMT2AKDM4EMAPT
Bromide SCHEMBL8064197 0.94 HTT (0.43) HTTPTGS1KMT2AKDM4EMAPT
Hydrochloric Acid SCHEMBL7037743 0.94 HTT (0.43) HTTPTGS1KMT2AKDM4EMAPT

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
US-4775419-A Metal amine complexes for improving the bond strength properties of asphalt MORTON THIOKOL, INC. (US) 1988-10-04 US disclosed
EP-0125852-B1 METAL AMINE COMPLEXES FOR IMPROVING THE BOND STRENGTH PROPERTIES OF ASPHALT MORTON THIOKOL, INC. (US) 1988-07-20 EP disclosed
EP-0125852-A1 Metal amine complexes for improving the bond strength properties of asphalt MORTON THIOKOL, INC. (US) 1984-11-21 EP disclosed