SCHEMBL4776517

SCHEMBL4776517

CC(=O)c1cc(O)c(O)cc1[N+](=O)[O-]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.50
ALOX15 P16050 3/20 0.47
ALOX12 P18054 3/20 0.47
MAPT P10636 2/20 0.44
GPR35 Q9HC97 5/20 0.44
ALDH1A1 P00352 3/20 0.42
CYP3A4 P08684 1/20 0.42
HPGD P15428 2/20 0.41
MAPK1 P28482 2/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
TTR P02766 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
RECQL P46063 1/20 0.41
PMP22 Q01453 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL29538041 1.00 SNCA (0.50) SNCAALOX15ALOX12MAPTGPR35
SCHEMBL15214019 0.85 TTR (0.43) ALOX15ALOX12MAPTGPR35ALDH1A1
SCHEMBL14546684 0.83 SNCA (0.46) SNCAALOX15ALOX12MAPTGPR35
SCHEMBL9908176 0.83 HTT (0.54) MAPTCYP3A4KDM4E
SCHEMBL14298925 0.82 DTYMK (0.53) SNCAALOX15ALOX12MAPTGPR35
SCHEMBL19373203 0.81 L3MBTL1 (0.39) MAPTGPR35CYP3A4CA12CA9
SCHEMBL13483711 0.80 TSHR (0.44) MAPTGPR35ALDH1A1CYP3A4HPGD
SCHEMBL16808906 0.79 GPR35 (0.49) SNCAALOX15ALOX12MAPTGPR35
SCHEMBL16808895 0.79 ALOX15 (0.56) SNCAALOX15ALOX12GPR35ALDH1A1
SCHEMBL9744165 0.78 CA12 (0.50) MAPTGPR35ALDH1A1CYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11225461-B2 Compound, substrate for pattern formation, photodegradable coupling agent, pattern formation method, and transistor production method NIKON CORPORATION (JP) 2022-01-18 US disclosed
US-20190352260-A1 COMPOUND, SUBSTRATE FOR PATTERN FORMATION, PHOTODEGRADABLE COUPLING AGENT, PATTERN FORMATION METHOD, AND TRANSISTOR PRODUCTION METHOD NIKON CORPORATION (JP) 2019-11-21 US disclosed
US-20170285471-A1 FLUORINE-CONTAINING COMPOSITION, SUBSTRATE FOR PATTERN FORMATION, PHOTODEGRADABLE COUPLING AGENT, PATTERN FORMATION METHOD AND TRANSISTOR PRODUCTION METHOD NIKON CORPORATION (JP) 2017-10-05 US disclosed
US-20160152642-A1 FLOURINE-CONTAINING COMPOUND, SUBSTRATE FOR PATTERNING, PHOTODEGRADABLE COUPLING AGENT, PATTERNING METHOD, AND COMPOUND KANAGAWA UNIVERSITY (JP) 2016-06-02 US disclosed
EP-1991530-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2008-11-19 EP disclosed
EP-1991540-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2008-11-19 EP disclosed
US-20070265270-A1 Cinnoline derivatives as phosphodiesterase 10 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-11-15 US disclosed
US-20070265256-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-11-15 US disclosed
WO-2007098214-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-08-30 WO disclosed
WO-2007098169-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-08-30 WO disclosed
WO-2006028957-A1 4-SUBSTITUTED 4, 6-DIALKOXY-CINNOLINE DERIVATIVES AS PHOSPODIESTERASE 10 INHIBITORS FOR THE TREATMENT OF PSYCHIATRIC OR NEUROLOGICAL SYNDROMS MEMORY PHARMACEUTICALS CORPORATION (US) 2006-03-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11225461-B2 Compound, substrate for pattern formation, photodegradable coupling agent, pattern formation method, and transistor production method CYP3A4, CYP4F11, COASY SNCA 2423/4885ALOX15 918/4885ALOX12 663/4885
US-20190352260-A1 COMPOUND, SUBSTRATE FOR PATTERN FORMATION, PHOTODEGRADABLE COUPLING AGENT, PATTERN FORMATION METHOD, AND TRANSISTOR PRODUCTION METHOD CYP3A4, CYP4F11, COASY SNCA 2423/4885ALOX15 918/4885ALOX12 663/4885
US-20070265270-A1 Cinnoline derivatives as phosphodiesterase 10 inhibitors PDE7A, PDE10A, PDE7B SNCA 779/4885ALOX15 2549/4885ALOX12 2962/4885
US-20070265256-A1 Phosphodiesterase 10 inhibitors PDE7A, PDE7B, PDE10A SNCA 794/4885ALOX15 3218/4885ALOX12 3507/4885
US-20160152642-A1 FLOURINE-CONTAINING COMPOUND, SUBSTRATE FOR PATTERNING, PHOTODEGRADABLE COUPLING AGENT, PATTERNING METHOD, AND COMPOUND AFF1, AFF2, AFF4 SNCA 3818/4885ALOX15 2363/4885ALOX12 1283/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.