SCHEMBL7904840

SCHEMBL7904840

COC(=O)CC1CCCCO1.[AlH3]

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
PDE8B O95263 1/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 2/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
USP2 O75604 1/20 0.40
SLC6A3 Q01959 2/20 0.39

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
SCHEMBL3862180 0.98 HPGD (0.45) HPGDLMNAPOLBKMT2AMEN1
SCHEMBL15058806 0.93 LMNA (0.50) HPGDLMNAPOLBKMT2AMEN1
SCHEMBL2125917 0.93 LMNA (0.50) HPGDLMNAPOLBKMT2AMEN1
SCHEMBL321971 0.87
SCHEMBL23501577 0.81 HPGD (0.43) HPGDLMNAPOLBKMT2AMEN1
SCHEMBL1961403 0.81 POLB (0.46) HPGDLMNAPOLBALDH1A1HTT
SCHEMBL5899164 0.81 LMNA (0.46) HPGDLMNAPOLBKMT2AMEN1
SCHEMBL29878165 0.79 POLB (0.45) HPGDLMNAPOLBKMT2AMEN1
SCHEMBL23501583 0.78 LMNA (0.51) HPGDLMNAPOLBKMT2AMEN1
SCHEMBL17997798 0.77 HPGD (0.45) HPGDLMNAPOLBKMT2AMEN1

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
EP-1070029-A1 CHEMICAL CONTROL OVER CERAMIC POROSITY USING CARBOXYLATE-ALUMOXANES William Marsh Rice University (US) 2001-01-24 EP disclosed
WO-1999050203-A1 CHEMICAL CONTROL OVER CERAMIC POROSITY USING CARBOXYLATE-ALUMOXANES WM MARSH RICE UNIVERSITY (US) 1999-10-07 WO disclosed