SCHEMBL5570187

SCHEMBL5570187

CON=C1CC(C(N)=NO)N(C(=O)c2ccc(-c3ccccc3C)cc2)C1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 6/20 0.69
OXTR P30559 5/20 0.69
AVPR2 P30518 3/20 0.42
SLC6A7 Q99884 1/20 0.40
FFAR2 O15552 4/20 0.39
GHSR Q92847 1/20 0.39
HTR1D P28221 1/20 0.37
HTR1B P28222 1/20 0.37
CDK4 P11802 1/20 0.36
CCND1 P24385 1/20 0.36
SPHK1 Q9NYA1 3/20 0.35

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
SCHEMBL5570185 1.00 AVPR1A (0.69) AVPR1AOXTRAVPR2SLC6A7FFAR2
SCHEMBL5473608 1.00 AVPR1A (0.69) AVPR1AOXTRAVPR2SLC6A7FFAR2
SCHEMBL5484719 0.91 AVPR1A (0.73) AVPR1AOXTRAVPR2SLC6A7FFAR2
SCHEMBL4936752 0.91 AVPR1A (0.73) AVPR1AOXTRAVPR2SLC6A7FFAR2
SCHEMBL24313450 0.89 AVPR1A (0.79) AVPR1AOXTRAVPR2SLC6A7FFAR2
SCHEMBL5476815 0.89 OXTR (0.61) AVPR1AOXTRSLC6A7FFAR2SPHK1
SCHEMBL5034150 0.89 AVPR1A (0.79) AVPR1AOXTRAVPR2SLC6A7FFAR2
SCHEMBL13083574 0.89 OXTR (0.61) AVPR1AOXTRSLC6A7FFAR2SPHK1
SCHEMBL4416107 0.89 AVPR1A (0.79) AVPR1AOXTRAVPR2SLC6A7FFAR2
SCHEMBL5476808 0.89 OXTR (0.61) AVPR1AOXTRSLC6A7FFAR2SPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1725526-B1 METHOD FOR PREPARING PYRROLIDINE OXIMES SERONO LAB (CH) 2007-12-12 EP disclosed