SCHEMBL28018679

SCHEMBL28018679

COC(C(=O)N(C)OC)c1cccnc1C1CNCCO1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
REN P00797 3/20 0.35
SLC6A3 Q01959 1/20 0.35
TAAR1 Q96RJ0 1/20 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
SCHEMBL29034259 0.78 REN (0.38) REN
SCHEMBL27513742 0.73 DRD2 (0.36) SLC6A3TAAR1
SCHEMBL28029236 0.72 ADRA2C (0.52) SLC6A3
SCHEMBL8218635 0.71 TAAR1 (0.44) SLC6A3TAAR1
SCHEMBL28666083 0.70 DRD2 (0.50)
SCHEMBL28010292 0.70 DRD2 (0.42) SLC6A3TAAR1
SCHEMBL28105993 0.69 DRD2 (0.42)
SCHEMBL28018712 0.68 FAAH (0.39) RENSLC6A3
SCHEMBL2388114 0.68 MEN1 (0.41)
SCHEMBL28860435 0.68 DRD2 (0.41) SLC6A3

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
CN-104710385-A PDE10 inhibitors and related compositions and methods OMEROS CORP 2015-06-17 CN disclosed