SCHEMBL5944524

SCHEMBL5944524

CCC[N+](C)(CC)c1ccc(C)cc1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
IDO1 P14902 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL5944418 0.93 ACHE (0.40) ACHETDP1IDO1HPGD
SCHEMBL5944481 0.86 ACHE (0.42) ACHETDP1IDO1
SCHEMBL5309968 0.80 APOBEC3A (0.42) ACHETDP1
Bromide SCHEMBL1597820 0.78 APOBEC3A (0.41) ACHETDP1
SCHEMBL5944653 0.77 ACHE (0.38) ACHETDP1IDO1HPGD
SCHEMBL5944482 0.77 ACHE (0.38) ACHETDP1IDO1HPGD
SCHEMBL9712020 0.74 ACHE (0.44) ACHETDP1IDO1HPGD
SCHEMBL30172946 0.73
Toluene SCHEMBL28224186 0.72 DNM1 (0.47) ACHE
SCHEMBL15430820 0.72 ACHE (0.43) ACHETDP1IDO1

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-20060186419-A1 Light-emitting device KABUSHIKI KAISHA TOSHIBA (JP) 2006-08-24 US disclosed