SCHEMBL6671627

SCHEMBL6671627

CC(=O)O[C@@H]1COC[C@H]1OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.49
ALDH1A1 P00352 1/20 0.47
METAP2 P50579 2/20 0.42
MERTK Q12866 3/20 0.41
AXL P30530 2/20 0.41
PSEN1 P49768 2/20 0.41
PSEN2 P49810 2/20 0.41
APH1B Q8WW43 2/20 0.41
NCSTN Q92542 2/20 0.41
APH1A Q96BI3 2/20 0.41
PSENEN Q9NZ42 2/20 0.41
KLK7 P49862 2/20 0.40
KLK5 Q9Y337 1/20 0.40

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
SCHEMBL22965651 0.90 BCHE (0.48) BCHEALDH1A1METAP2
SCHEMBL23867726 0.90 BCHE (0.47) BCHEALDH1A1METAP2MERTKAXL
SCHEMBL25906367 0.80 PSEN1 (0.42) BCHEPSEN1PSEN2APH1BNCSTN
SCHEMBL8425927 0.79 ALDH1A1 (0.50) BCHEALDH1A1
SCHEMBL404401 0.79 BCHE (0.49) BCHEALDH1A1METAP2KLK7KLK5
SCHEMBL402725 0.79 BCHE (0.46) BCHEALDH1A1KLK7KLK5
SCHEMBL14478921 0.79 BCHE (0.49) BCHEALDH1A1METAP2KLK7KLK5
SCHEMBL14362993 0.79 BCHE (0.49) BCHEALDH1A1METAP2KLK7KLK5
SCHEMBL19976411 0.79 BCHE (0.46) BCHEALDH1A1KLK7KLK5
SCHEMBL22236634 0.78 BCHE (0.48) BCHEALDH1A1METAP2PSEN1PSEN2

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-1237884-B1 PROCESS FOR THE PREPARATION OF TRANS-3-ALKYLOXY-4-HYDROXYTETRAHYDROFURAN EASTMAN CHEM CO (US) 2004-09-15 EP disclosed
US-6140516-A Process for the preparation of trans-3-alkyloxy-4-hydroxytetrahydrofuran EASTMAN CHEMICAL COMPANY (US) 2000-10-31 US disclosed