SCHEMBL28290479

SCHEMBL28290479

O=CCCOc1[c]cccc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL6238419 0.82 JAK2 (0.33) ALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL3124829 0.81 — —
SCHEMBL6196145 0.81 KDM4E (0.41) ALDH1A1HPGDSMN1; SMN2
SCHEMBL767167 0.81 CTSS (0.36) ALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL6721192 0.79 — —
SCHEMBL8583545 0.75 — —
SCHEMBL188983 0.75 KDM4E (0.48) ALDH1A1HPGDSMN1; SMN2
SCHEMBL126227 0.75 ALDH1A1 (0.34) ALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL2458787 0.75 — —
SCHEMBL348920 0.75 ALDH1A1 (0.48) ALDH1A1HTTSMN1; 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-109563103-A modulators of beta-3 adrenergic receptors for the treatment or prevention of disorders related thereto 艾尼纳制药公司 2019-04-02 — — CN disclosed
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