SCHEMBL7869426

SCHEMBL7869426

C=C(C)CNc1ccccc1C1=NNC(=O)/C1=C/c1c(C)nn(-c2ccccc2)c1O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.37
▸ MAPK1 P28482 3/20 0.37
▸ KMT2A Q03164 5/20 0.35
▸ LMNA P02545 4/20 0.35
▸ MEN1 O00255 4/20 0.35
▸ HPGD P15428 3/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ RECQL P46063 1/20 0.35
▸ CDK1 P06493 3/20 0.33
▸ CCNB1 P14635 3/20 0.33
▸ CCNE1 P24864 3/20 0.33
▸ CDK2 P24941 3/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.32
▸ S1PR4 O95977 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ S1PR1 P21453 1/20 0.32
▸ L3MBTL1 Q9Y468 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
SCHEMBL207145 0.75 MAPT (0.41) MAPTMAPK1KMT2ALMNAMEN1
SCHEMBL207147 0.65 POLB (0.47) MAPTMAPK1KMT2ALMNAMEN1
SCHEMBL13378760 0.65 POLB (0.47) MAPTMAPK1KMT2ALMNAMEN1
SCHEMBL420805 0.64 MAPT (0.60) MAPTMAPK1KMT2ALMNAMEN1
SCHEMBL445744 0.64 MAPT (0.60) MAPTMAPK1KMT2ALMNAMEN1
SCHEMBL8116198 0.64 MAPT (0.60) MAPTMAPK1KMT2ALMNAMEN1
SCHEMBL8883561 0.63 LMNA (0.60) MAPTMAPK1KMT2ALMNAMEN1
Acetic Acid SCHEMBL9593918 0.62 LMNA (0.56) MAPTMAPK1KMT2ALMNAHPGD
SCHEMBL206661 0.61 CES2 (0.41) KMT2AMEN1ALDH1A1CDK1CCNB1
SCHEMBL5928696 0.61 SMN1; SMN2 (0.40) MAPTMAPK1KMT2ALMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6310215-B1 EXCELLENT COPOLYMERIZABILITY AND UNDERGO NO ELUTION IN AN ORGANIC SOLVENT HOYA HEALTHCARE CORPORATION (JP) 2001-10-30 — — US disclosed
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