SCHEMBL5705285

SCHEMBL5705285

COC1OCC[C@@H]1NC(=O)[C@H](C)N

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 9/20 0.33
ARG1 P05089 1/20 0.32
CAPNS1 P04632 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL4807068 0.88 ARG1 (0.34) CAPN1ARG1HPGDTSHRNPSR1
SCHEMBL3635784 0.84 CAPN1 (0.39) CAPN1ARG1CAPNS1
SCHEMBL4620561 0.78 AAK1 (0.38)
SCHEMBL4801806 0.78 CAPN1 (0.46) CAPN1CAPNS1
SCHEMBL5705300 0.78 NPSR1 (0.31) NPSR1
SCHEMBL4623099 0.77 CAPN1 (0.45) CAPN1CAPNS1
SCHEMBL4806210 0.76 CAPN1 (0.46) CAPN1CAPNS1
SCHEMBL4623776 0.76 ALPI (0.41) CAPN1
SCHEMBL4806718 0.76 CAPN1 (0.35) CAPN1CAPNS1
SCHEMBL5705288 0.75 KDM1A (0.39)

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-1701974-A2 NOVEL 2-HYDROXYTETRAHYDROFURANE DERIVATIVES AND USE THEREOF AS MEDICAMENTS SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2006-09-20 EP disclosed
WO-2005056551-A2 NOVEL 2-HYDROXYTETRAHYDROFURANE DERIVATIVES AND USE THEREOF AS MEDICAMENTS SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2005-06-23 WO disclosed