SCHEMBL28296576

SCHEMBL28296576

[c]1ccnc2ccccc12.[c]1nccc2ccccc12

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
CYP1A2 P05177 2/20 0.32
GLA P06280 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
ACHE P22303 1/20 0.31

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
SCHEMBL8727 0.82 ALDH1A1 (0.41) ALDH1A1MAPT
SCHEMBL2080 0.80 ALDH1A1 (0.35) ALDH1A1CYP1A2GLAMAPTHPGD
SCHEMBL29103760 0.78 ALDH1A1 (0.33) ALDH1A1GLAMAPTHPGDACHE
SCHEMBL27475861 0.78 ALDH1A1 (0.33) ALDH1A1GLAMAPTHPGDACHE
SCHEMBL28399583 0.78 ALDH1A1 (0.33) ALDH1A1GLAMAPTHPGDACHE
SCHEMBL28256522 0.75 ALDH1A1 (0.35) ALDH1A1MAPT
SCHEMBL28144035 0.75 ALDH1A1 (0.35) ALDH1A1MAPT
SCHEMBL28258823 0.73 ALDH1A1 (0.32) ALDH1A1
SCHEMBL1825832 0.71
SCHEMBL275756 0.69 MAPT (0.41) ALDH1A1CYP1A2MAPT

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
CN-109804042-A Luminaire and electronic device including luminaire 陶氏环球技术有限责任公司 2019-05-24 CN disclosed