SCHEMBL7863387

SCHEMBL7863387

CCNc1ncn(Cc2ccc(OC)c(O)c2)c2nc(CC(C)O)nc1-2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNB2 O95067 2/20 0.39
CDK1 P06493 2/20 0.39
CCNB1 P14635 2/20 0.39
CCNB3 Q8WWL7 2/20 0.39
ALOX15 P16050 2/20 0.39
ALOX12 P18054 1/20 0.39
TLR7 Q9NYK1 2/20 0.38
KDM4E B2RXH2 3/20 0.36
TUBB1 Q9H4B7 2/20 0.35
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 1/20 0.35
TUBA1A Q71U36 1/20 0.35

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
Hydrochloric Acid SCHEMBL7860238 0.99 CCNB2 (0.39) CCNB2CDK1CCNB1CCNB3ALOX15
SCHEMBL7380803 0.86 CCNB2 (0.41) CCNB2CDK1CCNB1CCNB3ALOX15
Hydrochloric Acid SCHEMBL7205605 0.85 CCNB2 (0.40) CCNB2CDK1CCNB1CCNB3ALOX15
SCHEMBL7861139 0.85 PDE4A (0.48)
Hydrochloric Acid SCHEMBL7862248 0.84 PDE4A (0.47)
SCHEMBL7378069 0.84 CCNB2 (0.41) CCNB2CDK1CCNB1CCNB3ALOX15
SCHEMBL7740536 0.82 TLR7 (0.39) CCNB2CDK1CCNB1CCNB3ALOX15
Hydrochloric Acid SCHEMBL7204733 0.81 TLR7 (0.39) CCNB2CDK1CCNB1CCNB3ALOX15
Hydrochloric Acid SCHEMBL7863329 0.76 MAPK1 (0.42) KDM4ETSHRRAB9A
SCHEMBL27581623 0.74 TLR7 (0.37) TLR7YTHDC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1045849-A4 PURINE DERIVATIVES HAVING PHOSPHODIESTERASE IV INHIBITION ACTIVITY EURO CELTIQUE SA (LU) 2001-10-31 EP disclosed
EP-1045849-A1 PURINE DERIVATIVES HAVING PHOSPHODIESTERASE IV INHIBITION ACTIVITY Euro-Celtique S.A. (LU) 2000-10-25 EP disclosed
WO-1999031102-A1 PURINE DERIVATIVES HAVING PHOSPHODIESTERASE IV INHIBITION ACTIVITY EURO-CELTIQUE, S.A. (LU) 1999-06-24 WO disclosed