SCHEMBL623108

SCHEMBL623108

C/C(=C\C(=O)O)C(=O)O.C/C(=C\C(=O)O)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.45
KMT2A Q03164 1/20 0.39
PTGS1 P23219 1/20 0.39
AKR1C3 P42330 1/20 0.39
KDM4E B2RXH2 4/20 0.38
MAPT P10636 3/20 0.38
POLB P06746 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
FFAR3 O14843 1/20 0.38
LCK P06239 1/20 0.38
FYN P06241 1/20 0.38
ATM Q13315 1/20 0.37

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
SCHEMBL5894 1.00
SCHEMBL27531633 1.00 HTT (0.45) HTTKMT2APTGS1AKR1C3KDM4E
SCHEMBL6040109 1.00 HTT (0.45) HTTKMT2APTGS1AKR1C3KDM4E
SCHEMBL623803 1.00 HTT (0.45) HTTKMT2APTGS1AKR1C3KDM4E
SCHEMBL28517 1.00
SCHEMBL5893 1.00
SCHEMBL8089680 0.97 HTT (0.43) HTTKMT2APTGS1AKR1C3KDM4E
SCHEMBL10685484 0.97 HTT (0.43) HTTKMT2APTGS1AKR1C3KDM4E
Bromide SCHEMBL8064197 0.97 HTT (0.43) HTTKMT2APTGS1AKR1C3KDM4E
Ammonia Solution, Strong SCHEMBL16423856 0.97 HTT (0.43) HTTKMT2APTGS1AKR1C3KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113195565-B Aqueous polymer dispersions crosslinkable with amino acid crosslinkers for textiles 阿科玛法国公司 2023-10-13 CN disclosed
CN-103930558-A Microorganisms for producing methacrylic acid and methacrylate esters and methods related thereto GENOMATICA INC 2014-07-16 CN disclosed
US-8038954-B2 CSF with low platinum/palladium ratios BASF CORPORATION (US) 2011-10-18 US disclosed
US-20110243801-A1 Passivation-Free Coating Process for a CSF BASF CORPORATION (US) 2011-10-06 US disclosed
US-20110152435-A1 RESIN COMPOSITION KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2011-06-23 US disclosed
EP-2328970-A1 RESIN COMPOSITION Kabushiki Kaisha Toyota Chuo Kenkyusho (JP) 2011-06-08 EP disclosed
EP-1695088-A1 METHOD FOR ANALYSING METABOLITES Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2006-08-30 EP disclosed
WO-2005059556-A1 METHOD FOR ANALYSING METABOLITES MAX PLANCK GESELLLSCHAFT ZUR FÖRDERUNG DER WISSENSCHAFTEN E.V. (DE) 2005-06-30 WO disclosed