SCHEMBL11805296

SCHEMBL11805296

CN(C)c1ccc2c(c1)C(=O)N=NC2=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.58
▸ TERT O14746 1/20 0.42
▸ APP P05067 1/20 0.42
▸ KDM4E B2RXH2 4/20 0.41
▸ HSD17B10 Q99714 5/20 0.40
▸ HPGD P15428 4/20 0.40
▸ TSHR P16473 2/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ HIF1A Q16665 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ GLA P06280 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ MAPT P10636 3/20 0.39
▸ IP6K1 Q92551 1/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.38
▸ PDE3B Q13370 1/20 0.38
▸ PDE3A Q14432 1/20 0.38
▸ THRB P10828 1/20 0.38

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
SCHEMBL2270251 0.84 ALDH1A1 (0.46) ALDH1A1TERTAPPKDM4EHSD17B10
SCHEMBL2270707 0.84 ALDH1A1 (0.46) ALDH1A1TERTAPPKDM4EHSD17B10
SCHEMBL9879536 0.77 TERT (0.42) ALDH1A1TERTAPPKDM4EHSD17B10
SCHEMBL10926086 0.76 ALDH1A1 (0.59) ALDH1A1TERTAPPKDM4EHSD17B10
SCHEMBL9514250 0.76 ALDH1A1 (0.59) ALDH1A1TERTAPPKDM4EHSD17B10
SCHEMBL9769393 0.76 ALDH1A1 (0.59) ALDH1A1TERTAPPKDM4EHSD17B10
SCHEMBL9352371 0.73 ALDH1A1 (1.00) ALDH1A1APPKDM4EHSD17B10HPGD
SCHEMBL372275 0.71 ALDH1A1 (0.58) ALDH1A1KDM4EHSD17B10HPGDCYP3A4
SCHEMBL14430028 0.71 ALDH1A1 (0.53) ALDH1A1TERTAPPKDM4EHSD17B10
SCHEMBL3091326 0.71 ALDH1A1 (0.61) ALDH1A1HPGDTSHRCYP3A4TDP1

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-3933488-A CHEMILUMINESCENCE FUJI PHOTO FILM CO., LTD. (JA) 1976-01-20 — — US disclosed
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