SCHEMBL24972186

SCHEMBL24972186

C=C[C@@H](C)CCC(C)CN

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
GABBR2 O75899 1/20 0.30
GABBR1 Q9UBS5 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
SCHEMBL3253778 0.81
SCHEMBL17474716 0.78 ALDH1A1 (0.47) ALDH1A1GABBR2GABBR1
SCHEMBL65860 0.78 ALDH1A1 (0.47) ALDH1A1GABBR2GABBR1
SCHEMBL1285639 0.77
SCHEMBL17470068 0.77
SCHEMBL13771114 0.76
SCHEMBL3360849 0.75
SCHEMBL12965078 0.75
SCHEMBL11376220 0.75 TSHR (0.46)
Hydrochloric Acid SCHEMBL29997351 0.74

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
WO-2023004400-A1 DIBENZOXANTHENE QUENCHERS, USES, AND METHODS OF PREPARATION Life Technologies Corporation (US) 2023-01-26 WO disclosed