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SCHEMBL3244880

SCHEMBL3244880

CCOC(=O)c1ccc(N(Cc2cncs2)c2ccc(OC)c(OCC3CC3)c2)cc1.COc1ccc(N(Cc2cncs2)c2cccc(C(=O)OC(C)(C)C)c2)cc1OCC1CC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 12/20 0.38
▸ SREBF1 P36956 1/20 0.36
▸ LTC4S Q16873 3/20 0.35
▸ RXRA P19793 1/20 0.35
▸ PDE4A P27815 3/20 0.34
▸ PDE4C Q08493 3/20 0.34
▸ PDE4D Q08499 3/20 0.34
▸ NR1H2 P55055 1/20 0.34
▸ NR1H3 Q13133 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SLC2A1 P11166 1/20 0.34

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
SCHEMBL3212603 0.94 PDE4B (0.39) PDE4BLTC4SRXRAPDE4APDE4C
SCHEMBL3203551 0.91 PDE4B (0.42) PDE4BRXRAPDE4APDE4CPDE4D
SCHEMBL3192176 0.86 PDE4B (0.37) PDE4BLTC4SRXRAPDE4APDE4C
SCHEMBL3205815 0.84 HRH4 (0.38) PDE4BSREBF1PDE4APDE4CPDE4D
SCHEMBL3126048 0.84 SREBF1 (0.41) SREBF1NR1H2NR1H3ALDH1A1
SCHEMBL3218504 0.84 LTC4S (0.46) PDE4BLTC4SRXRAPDE4APDE4C
SCHEMBL3219592 0.83 NR1H2 (0.40) SREBF1NR1H2NR1H3
SCHEMBL3193270 0.82 PDE4B (0.45) PDE4BPDE4APDE4CPDE4D
SCHEMBL3121311 0.82 PDE4B (0.40) PDE4BLTC4SRXRAPDE4APDE4C
SCHEMBL3205143 0.82 ALDH1A1 (0.38) PDE4DALDH1A1KMT2A

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
WO-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 — — WO disclosed