SCHEMBL7094967

SCHEMBL7094967

O=COC=O.O=COCCOCCOCCO

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
TSHR P16473 2/20 0.46
MAPK1 P28482 1/20 0.46
THRB P10828 1/20 0.35
HTT P42858 1/20 0.35
MAPT P10636 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL3081170 0.93 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL25908423 0.93 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL22041029 0.93 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL1010288 0.93
Ethylene Glycol SCHEMBL15570614 0.91 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
Di(Hydroxyethyl)Ether SCHEMBL28108514 0.88 TSHR (0.59) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL126792 0.80 ALDH1A1 (0.32) MEN1KMT2ATSHRALDH1A1
SCHEMBL827285 0.80 ALDH1A1 (0.32) MEN1KMT2ATSHRALDH1A1
SCHEMBL813378 0.80 ALDH1A1 (0.32) MEN1KMT2ATSHRALDH1A1
SCHEMBL6578756 0.79 MEN1 (0.39) MEN1KMT2ATSHRMAPK1THRB

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-2003089771-A1 OPTIMIZING INLET AIR TEMPERATURE FOR GAS TRUBINES USING HEAT EXCHANGING FLUID COMPRISING ALKALI METAL FORMATE CLEARWATER INTERNATIONAL, LLC (US) 2003-10-30 WO disclosed