SCHEMBL19309154

SCHEMBL19309154

Cn1ccn(CC2CCCCCCCCCCCC2)c1=O

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE1C Q14123 6/20 0.44
PDE1A P54750 4/20 0.44
PDE1B Q01064 4/20 0.44
CYP11B2 P19099 1/20 0.40
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
KMT2A Q03164 1/20 0.37
CTSK P43235 1/20 0.36
CYP2B6 P20813 1/20 0.36
BRD4 O60885 1/20 0.36
CNR1 P21554 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
SCHEMBL31273193 0.72 CYP11B2 (0.48) PDE1CPDE1APDE1BCYP11B2PDE4A
SCHEMBL2196349 0.69 PDE1C (0.35) PDE1CPDE1APDE1BCYP2B6
SCHEMBL2196350 0.69 PDE1C (0.35) PDE1CPDE1APDE1BCYP2B6
SCHEMBL2196608 0.69 PDE1C (0.35) PDE1CPDE1APDE1B
SCHEMBL2196850 0.69 PDE1C (0.35) PDE1CPDE1APDE1BCYP2B6
SCHEMBL2195467 0.69 PDE1C (0.35) PDE1CPDE1APDE1BCYP2B6
SCHEMBL2196427 0.69 PDE1C (0.35) PDE1CPDE1APDE1B
SCHEMBL2196580 0.69 PDE1C (0.35) PDE1CPDE1APDE1BCYP2B6
SCHEMBL20858655 0.68 GSK3A (0.42) KMT2A
SCHEMBL1346670 0.68 GRIA2 (0.42) PDE1CPDE1APDE1BCYP11B2CNR1

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
US-9751844-B2 Precursor compound connected to solid support for manufacturing 18F radiopharmaceutical, method for manufacturing same, and application thereof FUTURECHEM CO., LTD. (KR) 2017-09-05 US disclosed