SCHEMBL8334459

SCHEMBL8334459

O=CC1CC=CCCC1Br

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.35
▸ ALOX15 P16050 1/20 0.35

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
SCHEMBL8475212 0.84 ALDH1A1 (0.37) ALDH1A1ALOX15
SCHEMBL10433083 0.72 — —
SCHEMBL13595177 0.72 — —
SCHEMBL12597887 0.72 — —
SCHEMBL10139309 0.72 — —
SCHEMBL14024890 0.70 ALDH1A1 (0.35) ALDH1A1ALOX15
SCHEMBL42869 0.67 — —
SCHEMBL16136558 0.67 — —
SCHEMBL8333941 0.65 — —
SCHEMBL17460637 0.64 — —

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
EP-0728742-B1 Novel retinoids HOFFMANN LA ROCHE (CH) 1999-10-20 — — EP disclosed
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