SCHEMBL27364677

SCHEMBL27364677

CC(C)CCCOc1ccc(-c2ccc3cc(C=O)ccc3c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 1/20 0.49
▸ ALDH1A1 P00352 5/20 0.44
▸ MAPT P10636 4/20 0.44
▸ LMNA P02545 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ CHRNB2 P17787 1/20 0.39
▸ CHRNB4 P30926 1/20 0.39
▸ CHRNA3 P32297 1/20 0.39
▸ CHRNA7 P36544 1/20 0.39
▸ CHRNA4 P43681 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ MAPK1 P28482 1/20 0.38
▸ DRD1 P21728 1/20 0.38
▸ ALDH1A3 P47895 1/20 0.37
▸ PPARA Q07869 1/20 0.37
▸ EPHX2 P34913 1/20 0.37
▸ KMT2A Q03164 1/20 0.36
▸ FDPS P14324 1/20 0.36

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
SCHEMBL7289924 0.89 ALDH1A1 (0.45) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL7283005 0.89 RARB (0.56) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL19018472 0.84 ALDH1A1 (0.60) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL3068736 0.81 TDP1 (0.54) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL7271691 0.80 GSTO1 (0.46) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL2859226 0.78 GSTO1 (0.40) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL31498248 0.78 ALDH1A1 (0.57) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL13523844 0.77 RARB (0.48) RARBALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL7079626 0.76 TDP1 (0.59) ALDH1A1MAPTLMNASMN1; SMN2HPGD
SCHEMBL11806698 0.74 ALDH1A1 (0.53) RARBALDH1A1MAPTLMNASMN1; SMN2

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-1057306-C New polypeptide compound and a process for preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 2000-10-11 — — CN disclosed
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