SCHEMBL19903112

SCHEMBL19903112

Cc1cc(N2CCN(C(=O)c3ccccc3-n3nccn3)CCO2)ncn1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HCRTR1 O43613 20/20 0.48
▸ HCRTR2 O43614 20/20 0.48

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
SCHEMBL19893856 0.86 HCRTR1 (0.62) HCRTR1HCRTR2
SCHEMBL22383531 0.86 HCRTR2 (0.43) HCRTR1HCRTR2
SCHEMBL22383476 0.85 HCRTR2 (0.44) HCRTR1HCRTR2
SCHEMBL22383510 0.83 HCRTR2 (0.62) HCRTR1HCRTR2
SCHEMBL22383503 0.82 HCRTR1 (0.57) HCRTR1HCRTR2
SCHEMBL19903016 0.82 HCRTR1 (0.61) HCRTR1HCRTR2
SCHEMBL19893969 0.78 HCRTR2 (0.50) HCRTR1HCRTR2
SCHEMBL19903121 0.77 HCRTR1 (0.47) HCRTR1HCRTR2
SCHEMBL19903099 0.77 HCRTR2 (0.50) HCRTR1HCRTR2
SCHEMBL19903091 0.77 HCRTR2 (0.52) HCRTR1HCRTR2

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-3287454-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2018-02-28 — — EP disclosed
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