SCHEMBL5275279

SCHEMBL5275279

[CH2]C(C)c1cccc(O)c1C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38
▸ GABRA1 P14867 2/20 0.36
▸ GABRB2 P47870 2/20 0.36
▸ TSHR P16473 2/20 0.33
▸ FAAH O00519 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ GABRB1 P18505 1/20 0.33
▸ GABRG2 P18507 1/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ HTR2C P28335 1/20 0.33
▸ GABRB3 P28472 1/20 0.33
▸ GABRA5 P31644 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
SCHEMBL16956724 0.92 GABRA1 (0.39) HDAC4HDAC2HDAC8GABRA1GABRB2
SCHEMBL9244494 0.83 HDAC4 (0.42) HDAC4HDAC2HDAC8GABRA1GABRB2
SCHEMBL7721762 0.79 HDAC4 (0.37) HDAC4HDAC2HDAC8GABRA1GABRB2
SCHEMBL2530090 0.79 HDAC4 (0.39) HDAC4HDAC2HDAC8GABRA1GABRB2
SCHEMBL7531576 0.78 HDAC4 (0.50) HDAC4HDAC2HDAC8CA1CA2
SCHEMBL6004412 0.78 HDAC4 (0.50) HDAC4HDAC2HDAC8CA1CA2
SCHEMBL3169205 0.76 HDAC4 (0.52) HDAC4HDAC2HDAC8CA1CA2
SCHEMBL16951488 0.74 GABRA1 (0.39) GABRA1GABRB2TSHRFAAHCA1
SCHEMBL7869684 0.74 TRPA1 (0.48) HDAC4HDAC2HDAC8CA1CA2
SCHEMBL16959127 0.73 HTR1A (0.34) HDAC4HDAC2HDAC8GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1851197-A2 PHENYLAZETIDINONE DERIVATIVES Microbia, Inc. (US) 2007-11-07 — — EP disclosed
WO-2006102674-A2 DIPHENYLHETEROCYCLE CHOLESTEROL ABSORPTION INHIBITORS MICROBIA, INC. (US) 2006-09-28 — — WO disclosed
WO-2006086562-A2 PHENYLAZETIDINONE DERIVATIVES MICROBIA, INC. (US) 2006-08-17 — — WO disclosed
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