SCHEMBL9050429

SCHEMBL9050429

Cc1nc(C23CCCN(CC2)C3)no1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32

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
Oxalic Acid SCHEMBL9051655 0.92 MGLL (0.32) HCRTR1HCRTR2
SCHEMBL1482842 0.76 HCRTR1 (0.36) HCRTR1HCRTR2
SCHEMBL9048701 0.75 HSD11B1 (0.44)
Bromide SCHEMBL1483227 0.75 HCRTR1 (0.35) HCRTR1HCRTR2
SCHEMBL9049643 0.71 HSD11B1 (0.46)
SCHEMBL9049387 0.71 KMT2A (0.33)
SCHEMBL9050553 0.71
SCHEMBL5922043 0.70 PDK2 (0.32)
Hydrochloric Acid SCHEMBL9703359 0.70 KMT2A (0.33)
Oxalic Acid SCHEMBL9051385 0.69 HSD11B1 (0.39) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0287356-B1 Bridgehead substituted azabicyclic derivatives BEECHAM GROUP PLC (GB) 1996-01-24 EP claimed
EP-0287356-A2 Bridgehead substituted azabicyclic derivatives BEECHAM GROUP PLC (GB) 1988-10-19 EP claimed