SCHEMBL458210

SCHEMBL458210

CCc1ccc(N2CCC(CO)CC2)nn1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 8/20 0.39
▸ LMNA P02545 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ PIK3CA P42336 2/20 0.38
▸ MTOR P42345 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ CDK4 P11802 1/20 0.37
▸ CDK6 Q00534 1/20 0.37
▸ PDE2A O00408 1/20 0.37
▸ PDE1B Q01064 1/20 0.37
▸ PDE4D Q08499 1/20 0.37
▸ LRRK2 Q5S007 1/20 0.36

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
SCHEMBL20443214 0.84 NPC1 (0.37) PDE10ALMNAHTTMEN1KMT2A
SCHEMBL9195108 0.83 PDE10A (0.44) PDE10ALMNAHTTMEN1KMT2A
SCHEMBL22007467 0.80 ACHE (0.36) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL20255732 0.79 CDK4 (0.40) CDK4CDK6
SCHEMBL9219556 0.79 HRH3 (0.50) PDE10ALMNAHTTMEN1KMT2A
SCHEMBL24299592 0.78 PIK3CA (0.40) PDE10ALMNAHTTMEN1KMT2A
SCHEMBL20255203 0.78 PDE10A (0.40) PDE10ALMNAHTTMEN1KMT2A
SCHEMBL30790717 0.78 PIK3CA (0.40) PDE10ALMNAHTTMEN1KMT2A
SCHEMBL9198277 0.78 LMNA (0.61) PDE10ALMNAHTTMEN1KMT2A
SCHEMBL20038254 0.78 PDE10A (0.41) PDE10ALMNAHTTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 — — WO disclosed
WO-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 — — WO disclosed
EP-0577217-A1 Tetrazolyl-(phenoxy and phenoxyalkyl) piperidininylpyridazines as antiviral agents STERLING WINTHROP INC. (US) 1994-01-05 — — EP disclosed
US-5242924-A Tetrazolyl-(phenoxy and phenoxyalkyl)-piperidinylpyridazines as antiviral agents STERLING WINTHROP INC. (US) 1993-09-07 — — US disclosed
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