SCHEMBL4238705

SCHEMBL4238705

[N-]=[N+]=C1C=CC=C2C(=O)c3ccccc3C(=O)C21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 2/20 0.38
TTK P33981 1/20 0.38
MAPK8 P45983 1/20 0.38
MAPK9 P45984 1/20 0.38
MAPT P10636 6/20 0.37
TP53 P04637 4/20 0.37
MAPK1 P28482 3/20 0.37
LMNA P02545 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP1A2 P05177 1/20 0.37
HTR2B P41595 1/20 0.37
KMT2A Q03164 8/20 0.33
MEN1 O00255 7/20 0.33
RAB9A P51151 6/20 0.33
NPC1 O15118 6/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
KDM4E B2RXH2 2/20 0.33
GAA P10253 1/20 0.33
ALDH1A1 P00352 2/20 0.33
CDC25B P30305 1/20 0.32

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
SCHEMBL5094564 0.91 MAPT (0.39) MAPK10TTKMAPK8MAPK9MAPT
SCHEMBL3274379 0.79 MAPT (0.42) MAPK10TTKMAPK8MAPK9MAPT
SCHEMBL10721372 0.79 PIM1 (0.33) MAPTTP53MAPK1LMNACYP3A4
SCHEMBL5969253 0.78 MAPT (0.41) MAPK10TTKMAPK8MAPK9MAPT
SCHEMBL8346760 0.76 MAPT (0.40) MAPK10TTKMAPK8MAPK9MAPT
SCHEMBL8794463 0.76 MAPT (0.40) MAPK10TTKMAPK8MAPK9MAPT
SCHEMBL1197981 0.76 MAPT (0.40) MAPK10TTKMAPK8MAPK9MAPT
SCHEMBL15226169 0.73 MAPK10 (0.38) MAPK10TTKMAPK8MAPK9MAPT
Hydrochloric Acid SCHEMBL11335865 0.70 RAB9A (0.37) MAPK10TTKMAPK8MAPK9MAPT
SCHEMBL4245497 0.69 MAPK10 (0.35) MAPK10TTKMAPK8MAPK9MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116027636-A Positive photosensitive resin composition and method for producing cured pattern 江苏汉拓光学材料有限公司 2023-04-28 CN disclosed
EP-2983232-B1 LITHIUM STORAGE BATTERY COMPRISING A POSITIVE ELECTRODE MATERIAL MADE OF A SPECIFIC CARBON MATERIAL FUNCTIONALISED BY SPECIFIC ORGANIC COMPOUNDS COMMISSARIAT L ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2017-09-13 EP disclosed
US-20160043386-A1 LITHIUM ACCUMULATOR COMPRISING A POSITIVE ELECTRODE MATERIAL BASED ON A SPECIFIC CARBON MATERIAL FUNCTIONALIZED BY SPECIFIC ORGANIC COMPOUNDS Commissariat à l'énergie atomique et aux énergies alternatives (FR) 2016-02-11 US disclosed
EP-2983232-A1 LITHIUM STORAGE BATTERY COMPRISING A POSITIVE ELECTRODE MATERIAL MADE OF A SPECIFIC CARBON MATERIAL FUNCTIONALISED BY SPECIFIC ORGANIC COMPOUNDS Commissariat à l'Énergie Atomique et aux Énergies Alternatives (FR) 2016-02-10 EP disclosed
WO-2009128964-A2 ENSEMBLE-BASED VIRTUAL SCREENING REVEALS NOVEL ANTIVIRAL COMPOUNDS FOR AVIAN INFLUENZA NEURAMINIDASE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-10-22 WO disclosed