SCHEMBL27561331

SCHEMBL27561331

[CH2]CCCCCCCCCc1cc(C(=O)O)cc(C(=O)O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 9/20 0.41
▸ MAPT P10636 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ RARA P10276 1/20 0.41
▸ MTOR P42345 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TTR P02766 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ KAT8 Q9H7Z6 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ PPARA Q07869 1/20 0.36
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA7 P43166 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ CA14 Q9ULX7 1/20 0.35
▸ LCK P06239 1/20 0.35
▸ FYN P06241 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
SCHEMBL9096952 1.00 RARB (0.41) RARBMAPTMEN1ALDH1A1RARA
SCHEMBL7544521 0.82 RARB (0.42) RARBMAPTMEN1ALDH1A1RARA
SCHEMBL27388069 0.82 RARB (0.42) RARBMAPTMEN1ALDH1A1RARA
SCHEMBL7473225 0.82 FOLH1 (0.54) MEN1KMT2ARXFP1
SCHEMBL9100795 0.81 RARB (0.62) RARBMAPTMEN1ALDH1A1RARA
SCHEMBL3293447 0.81 RARB (0.62) RARBMAPTMEN1ALDH1A1RARA
SCHEMBL17060014 0.81 RARB (0.62) RARBMAPTMEN1ALDH1A1RARA
SCHEMBL28032028 0.81 RARB (0.62) RARBMAPTMEN1ALDH1A1RARA
SCHEMBL27389337 0.81 RARB (0.41) RARBMAPTMEN1ALDH1A1RARA
SCHEMBL6817153 0.79 MAPT (0.43) RARBMAPTMEN1ALDH1A1RARA

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-1183775-A Polyazacycloalkane compounds NYCOMED IMAGING AS (NO) 1998-06-03 — — CN disclosed
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