SCHEMBL7995134

SCHEMBL7995134

COc1c(C)c(C)[c]c(C)c1C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.32

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
SCHEMBL11308950 0.75 ACHE (0.40) ACHE
SCHEMBL2952712 0.75 ACHE (0.40) ACHE
SCHEMBL85826 0.72 ACHE (0.38) ACHE
SCHEMBL2494937 0.69 ACHE (0.36) ACHE
SCHEMBL8304984 0.67
SCHEMBL8915846 0.67 ACHE (0.35) ACHE
SCHEMBL15069742 0.66
SCHEMBL484326 0.66 AGXT (0.32) ACHE
SCHEMBL2204547 0.66 TDP1 (0.31)
SCHEMBL14217694 0.65 ACHE (0.38) ACHE

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6294521-B1 SUGAR PHOSPHATES AUSTRALIAN NATIONAL UNIVERSITY (AU) 2001-09-25 US disclosed
EP-0658585-B1 Aminophenylalanine derivatives, process for their production, their use and agents containing them as anti-coagulants STUEBER WERNER (DE) 2000-07-19 EP disclosed
US-5571844-A Amidinophenylalanine derivatives, a process for their preparation, their use and compositions containing these as anticoagulants BEHRINGWERKE AKTIENGESELLSCHAFT (DE) 1996-11-05 US disclosed
EP-0513543-B1 Derivatives of amidinophenylalanine, procedure for their preparation, their utilisation and anticoagulant compositions comprising them. BEHRINGWERKE AG (DE) 1995-10-25 EP disclosed
EP-0658585-A2 Aminophenylalanine derivatives, process for their production, their use and agents containing them as anti-coagulants BEHRINGWERKE Aktiengesellschaft (DE) 1995-06-21 EP disclosed
EP-0513543-A1 Derivatives of amidinophenylalanine, procedure for their preparation, their utilisation and anticoagulant compositions comprising them. BEHRINGWERKE Aktiengesellschaft (DE) 1992-11-19 EP disclosed