SCHEMBL8397279

SCHEMBL8397279

N=C(NC12CC3CC(CC(C3)C1)C2)N(N)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 8/20 0.44
EPHX1 P07099 2/20 0.44
SIGMAR1 Q99720 5/20 0.41
POLB P06746 1/20 0.36

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
SCHEMBL15975483 0.78 EPHX2 (0.53) EPHX2EPHX1POLB
SCHEMBL1237952 0.71 EPHX2 (0.54) EPHX2EPHX1SIGMAR1POLB
SCHEMBL3079393 0.71 EPHX2 (0.58) EPHX2EPHX1SIGMAR1
SCHEMBL3081626 0.69 EPHX2 (0.47) EPHX2EPHX1SIGMAR1POLB
Hydrochloric Acid SCHEMBL6158167 0.69 EPHX2 (0.56) EPHX2EPHX1SIGMAR1
SCHEMBL6720885 0.67 FAAH (0.42) EPHX2EPHX1
SCHEMBL3069081 0.67 EPHX2 (0.54) EPHX2EPHX1SIGMAR1
SCHEMBL8920876 0.67 GRIN2D (0.38) EPHX2EPHX1SIGMAR1POLB
SCHEMBL6681638 0.66 EPHX2 (0.52) EPHX2EPHX1SIGMAR1
SCHEMBL7401097 0.66 THRB (0.42) EPHX2EPHX1SIGMAR1POLB

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-0918460-A1 METHODS OF TREATMENT OF EYE TRAUMA AND DISORDERS CAMBRIDGE NEUROSCIENCE, INC. (US) 1999-06-02 EP disclosed
WO-1998004131-A1 METHODS OF TREATMENT OF EYE TRAUMA AND DISORDERS CAMBRIDGE NEUROSCIENCE, INC. (US) 1998-02-05 WO disclosed