SCHEMBL4024671

SCHEMBL4024671

Nc1ncnc2c1nc(NCc1cccnc1)n2CCO

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC28A2 O43868 9/20 0.51
FBP1 P09467 2/20 0.50
ADORA2A P29274 4/20 0.49
ADORA1 P30542 4/20 0.49
ADORA2B P29275 3/20 0.49
HSPA8 P11142 5/20 0.48
ADORA3 P0DMS8 2/20 0.47
HSPA5 P11021 2/20 0.45
MAPK1 P28482 1/20 0.43
KDM4C Q9H3R0 1/20 0.43

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
SCHEMBL4025801 0.90 FBP1 (0.48) SLC28A2FBP1ADORA2AADORA1HSPA8
SCHEMBL4022673 0.89 FBP1 (0.48) SLC28A2FBP1ADORA2AADORA1HSPA8
SCHEMBL4025797 0.89 FBP1 (0.48) SLC28A2FBP1ADORA2AADORA1HSPA8
SCHEMBL27708066 0.87 SLC28A2 (0.49) SLC28A2FBP1ADORA2AADORA1ADORA2B
SCHEMBL4402903 0.87 SLC28A2 (0.47) SLC28A2FBP1ADORA2AADORA1HSPA8
SCHEMBL985660 0.83 ADORA2A (0.51) SLC28A2FBP1ADORA2AADORA1ADORA2B
SCHEMBL985294 0.81 ADORA2A (0.51) FBP1ADORA2AADORA1ADORA2BADORA3
SCHEMBL6762603 0.75 SLC28A2 (0.83) SLC28A2HSPA8HSPA5
SCHEMBL15089829 0.73 TMIGD3 (0.43) ADORA2AADORA1ADORA2BMAPK1KDM4C
SCHEMBL986123 0.73 ADORA2A (0.57) ADORA2AADORA1ADORA2BADORA3MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101115764-B New macrolides BASILEA PHARMACEUTICA AG 2012-09-26 CN disclosed
US-7524823-B2 Macrolides BASILEA PHARMACEUTICA AG (CH) 2009-04-28 US disclosed
EP-1846430-B1 NEW MACROLIDES BASILEA PHARMACEUTICA AG (CH) 2009-04-01 EP disclosed
EP-1846430-A1 NEW MACROLIDES Basilea Pharmaceutica AG (CH) 2007-10-24 EP disclosed
US-20060264387-A1 Macrolides BASILEA PHARMACEUTICA AG (CH) 2006-11-23 US disclosed
WO-2006084410-A1 NEW MACROLIDES BASILEA PHARMACEUTICA AG (CH) 2006-08-17 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060264387-A1 Macrolides PPME1, MGAM, SMPD1 SLC28A2 1570/4885FBP1 203/4885ADORA2A 3969/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.