SCHEMBL30660239

SCHEMBL30660239

Fc1ccccc1CCCc1ccccc1F

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 3/20 0.68
▸ AOC3 Q16853 1/20 0.54
▸ MPO P05164 4/20 0.53
▸ IDO1 P14902 2/20 0.50
▸ SLC6A4 P31645 1/20 0.48
▸ LMNA P02545 1/20 0.45
▸ MAOB P27338 2/20 0.44
▸ DAO P14920 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL29481487 0.89 TAAR1 (0.56) TAAR1AOC3MPOIDO1LMNA
SCHEMBL8526001 0.88 TAAR1 (0.75) TAAR1AOC3MPOIDO1LMNA
SCHEMBL1287446 0.87 TAAR1 (0.74) TAAR1AOC3MPOIDO1SLC6A4
SCHEMBL31069232 0.85 TAAR1 (0.58) TAAR1AOC3MPOIDO1SLC6A4
SCHEMBL80668 0.85 TAAR1 (0.58) TAAR1AOC3MPOIDO1SLC6A4
SCHEMBL31069259 0.85 TAAR1 (0.58) TAAR1AOC3MPOIDO1SLC6A4
SCHEMBL1047480 0.85 TAAR1 (0.58) TAAR1AOC3MPOIDO1SLC6A4
SCHEMBL7213939 0.85 TAAR1 (0.58) TAAR1AOC3MPOIDO1SLC6A4
SCHEMBL79807 0.85 TAAR1 (0.58) TAAR1AOC3MPOIDO1SLC6A4
SCHEMBL3520428 0.85 TAAR1 (0.58) TAAR1AOC3MPOIDO1SLC6A4

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-20240000724-A1 Compositions and Methods for Treatment or Prevention of Oral Mucositis PATHWAYS BIOSCIENCE, LLC 2024-01-04 — — US claimed
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