SCHEMBL10460203

SCHEMBL10460203

C=CCOc1ccc(N2C(=O)CCC23CCC(=O)N3c2ccc(OCC=C)c(CC=C)c2)cc1CC=C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.42
▸ PTGDR Q13258 1/20 0.36
▸ PTGDR2 Q9Y5Y4 1/20 0.36
▸ KDM4E B2RXH2 4/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ TDP1 Q9NUW8 3/20 0.33
▸ POLB P06746 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HTT P42858 3/20 0.33
▸ P2RY12 Q9H244 1/20 0.33
▸ ADRA2A P08913 1/20 0.33
▸ ADRA2B P18089 1/20 0.33
▸ ADRA2C P18825 1/20 0.33
▸ MEN1 O00255 3/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ GAA P10253 2/20 0.32
▸ TSHR P16473 1/20 0.32
▸ PDE4B Q07343 1/20 0.32
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32

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
SCHEMBL9379698 0.84 MAPT (0.36) MAPTPTGDRPTGDR2ALDH1A1POLB
SCHEMBL9379078 0.80 GABRA1 (0.45) MAPTKDM4EALDH1A1POLBHPGD
SCHEMBL9375911 0.78 MMP13 (0.43) MAPTALDH1A1POLBADRA2AADRA2B
SCHEMBL10458196 0.76 KDM4E (0.33) MAPTKDM4EALDH1A1POLBHPGD
SCHEMBL9813473 0.75 PTGDR (0.40) MAPTPTGDRPTGDR2KDM4EALDH1A1
SCHEMBL10569169 0.74 SMN1; SMN2 (0.40) KDM4EALDH1A1POLBHPGDADRA2A
SCHEMBL5931990 0.68 GABRA1 (0.52) PTGDRPTGDR2HTTMEN1KMT2A
SCHEMBL10460430 0.68 KLF10 (0.39) MAPTALDH1A1POLBHPGDHTT
SCHEMBL11586876 0.67 CNR2 (0.52) MAPTPTGDRPTGDR2KDM4EALDH1A1
SCHEMBL8534293 0.67 KDM4E (0.48) MAPTPTGDRPTGDR2KDM4EALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4968811-A Alkenylphenol derivatives SHELL OIL COMPANY (US) 1990-11-06 — — US disclosed
US-4886863-A Novel alkenylphenol derivatives SHELL OIL COMPANY (US) 1989-12-12 — — US disclosed
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