3-Methylbutanol

3-Methylbutanol

SCHEMBL5564948

CC(C)CCO.CC(C)CCO.ClC(Cl)Cl.ClC(Cl)Cl

nearest known ligand 0.41

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Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.41
ALDH1A1 P00352 4/20 0.35
CA1 P00915 2/20 0.33
THRB P10828 1/20 0.33
ALOX15 P16050 1/20 0.33
LMNA P02545 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
DPP4 P27487 1/20 0.30

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
3-Methylbutanol SCHEMBL30869 1.00 TSHR (0.41) TSHRALDH1A1CA1THRBALOX15
3-Methylbutanol SCHEMBL28993065 1.00 TSHR (0.41) TSHRALDH1A1CA1THRBALOX15
3-Methylbutanol SCHEMBL3485868 1.00 TSHR (0.41) TSHRALDH1A1CA1THRBALOX15
3-Methylbutanol SCHEMBL5500556 1.00 TSHR (0.41) TSHRALDH1A1CA1THRBALOX15
3-Methylbutanol SCHEMBL28264364 0.94 TSHR (0.37) TSHRALDH1A1CA1THRBALOX15
3-Methylbutanol SCHEMBL28181245 0.90
3-Methylbutanol SCHEMBL901083 0.89 TSHR (0.50) TSHRALDH1A1CA1THRBALOX15
3-Methylbutanol SCHEMBL8407955 0.89 TSHR (0.50) TSHRALDH1A1CA1THRBALOX15
3-Methylbutanol SCHEMBL12054 0.89
3-Methylbutanol SCHEMBL6360717 0.87

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-1608219-A4 INTEGRASE MEDIATED AVIAN TRANSGENESIS AVIGENICS INC (US) 2007-03-14 EP disclosed
EP-1608219-A2 INTEGRASE MEDIATED AVIAN TRANSGENESIS Avigenics, Inc. (US) 2005-12-28 EP disclosed
WO-2004080162-A2 INTEGRASE MEDIATED AVIAN TRANSGENESIS AVIGENICS, INC. (US) 2004-09-23 WO disclosed