SCHEMBL7762059

SCHEMBL7762059

CC(C)(C)CCNc1ccccc1C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.43
GAA P10253 2/20 0.41
POLB P06746 1/20 0.41
THRB P10828 1/20 0.41
ALOX12 P18054 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
GRIN3A Q8TCU5 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
ALDH1A1 P00352 3/20 0.39
TDP1 Q9NUW8 2/20 0.38
TSHR P16473 1/20 0.38
LMNA P02545 1/20 0.36
CA2 P00918 1/20 0.34

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
SCHEMBL13159623 0.82 IDO1 (0.44) KMT2AGAAPOLBTHRBALOX12
SCHEMBL6404409 0.81 KDM4E (0.49) KMT2AGAAPOLBTHRBALOX12
SCHEMBL13159633 0.78 POLB (0.45) KMT2AGAAPOLBTHRBALOX12
SCHEMBL29922790 0.77 MAPT (0.41) KMT2AGAATHRBMAPTHTT
SCHEMBL21799639 0.77 MAPT (0.41) KMT2AGAATHRBMAPTHTT
SCHEMBL10408184 0.77 L3MBTL1 (0.49) KMT2AGAAPOLBTHRBALOX12
SCHEMBL13602479 0.74 CA12 (0.61) KMT2AGAAMAPTALDH1A1TDP1
SCHEMBL10116969 0.74 KMT2A (0.55) KMT2APOLBMAPTSIGMAR1ALDH1A1
SCHEMBL20699481 0.73 THRB (0.61) KMT2AGAAPOLBTHRBALOX12
SCHEMBL15250784 0.73 KMT2A (0.47) KMT2AGAAPOLBTHRBALOX12

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-6512006-B1 Novel 3-position Nitrogen substituted 6,6- disubstituted-5, 6-dihydropyrones and related compounds possess antiviral properties WARNER-LAMBERT COMPANY 2003-01-28 US disclosed