SCHEMBL15045192

SCHEMBL15045192

C[C@H](N)C(=O)N1CCC(Oc2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 1/20 0.57
EPHX2 P34913 5/20 0.51
NAMPT P43490 3/20 0.51
SCD5 Q86SK9 1/20 0.48
CHRM2 P08172 1/20 0.46
CHRM3 P20309 1/20 0.46
HRH3 Q9Y5N1 1/20 0.45
DRD2 P14416 3/20 0.45
DRD4 P21917 3/20 0.45
DRD3 P35462 3/20 0.45
SMYD3 Q9H7B4 1/20 0.45

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
SCHEMBL23136089 0.88 SRD5A1 (0.60) SRD5A1EPHX2NAMPTSCD5HRH3
Hydrochloric Acid SCHEMBL2775020 0.88 SRD5A1 (0.54) SRD5A1EPHX2NAMPTSCD5CHRM2
SCHEMBL27805791 0.86 SRD5A1 (0.49) SRD5A1EPHX2NAMPTHRH3SMYD3
SCHEMBL27805792 0.86 SRD5A1 (0.49) SRD5A1EPHX2NAMPTHRH3SMYD3
SCHEMBL27805800 0.86 EPHX2 (0.50) SRD5A1EPHX2NAMPTHRH3SMYD3
SCHEMBL27805799 0.86 EPHX2 (0.50) SRD5A1EPHX2NAMPTHRH3SMYD3
Hydrochloric Acid SCHEMBL2777270 0.85 HRH3 (0.49) SRD5A1EPHX2NAMPTHRH3SMYD3
Hydrochloric Acid SCHEMBL2773554 0.85 HRH3 (0.49) SRD5A1EPHX2NAMPTHRH3SMYD3
Hydrochloric Acid SCHEMBL2773459 0.82 EPHX2 (0.51) SRD5A1EPHX2
SCHEMBL14412821 0.80 EPHX2 (0.57) SRD5A1EPHX2NAMPTSCD5CHRM2

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-2604601-A1 HETERO RING COMPOUND Astellas Pharma Inc. (JP) 2013-06-19 EP disclosed