SCHEMBL7706336

SCHEMBL7706336

CCN(CC)c1ccnc2cnnn12

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
MAPK1 P28482 1/20 0.33
GBA1 P04062 1/20 0.32
GSK3B P49841 1/20 0.31

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
SCHEMBL843044 0.72 LMNA (0.51) LMNACYP1A2MAPK1
SCHEMBL7706332 0.68 LMNA (0.58) LMNACYP1A2MAPK1GSK3B
SCHEMBL3127589 0.67 NOS3 (0.30)
SCHEMBL8765848 0.67
SCHEMBL7201305 0.63 CRHR1 (0.43)
SCHEMBL29642153 0.63 GSK3B (0.44) LMNACYP1A2MAPK1GBA1GSK3B
SCHEMBL7966725 0.60 L3MBTL1 (0.36) MAPK1
SCHEMBL11001134 0.56 KDM4E (0.36) LMNACYP1A2MAPK1GBA1
SCHEMBL2254013 0.56 NUDT1 (0.47) LMNACYP1A2MAPK1
SCHEMBL14158421 0.55 DYRK1A (0.40)

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
US-6369065-B1 CEREBROVASCULAR AND CARDIOVASCULAR DISORDERS UCB S.A. (BE) 2002-04-09 US claimed
US-6369065-B1 CEREBROVASCULAR AND CARDIOVASCULAR DISORDERS UCB S.A. (BE) 2002-04-09 US disclosed