SCHEMBL5519902

SCHEMBL5519902

O=S(=O)(O)c1ccc(C=Cc2cccc(Nc3nc(Nc4ccccc4)nc(Nc4ccccc4)n3)c2Nc2nc(Nc3ccccc3)nc(Nc3ccccc3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 12/20 0.41
CA1 P00915 12/20 0.41
CA2 P00918 12/20 0.41
CA9 Q16790 12/20 0.41
SNCA P37840 1/20 0.40
SLC16A3 O15427 1/20 0.39
TTR P02766 1/20 0.38
FABP4 P15090 1/20 0.38
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
MAPK14 Q16539 1/20 0.38
NR4A1 P22736 1/20 0.38
CHAT P28329 2/20 0.37
RHOA P61586 1/20 0.37
PTPRA P18433 1/20 0.37
PTPRB P23467 1/20 0.37

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
SCHEMBL7778456 0.86 DDX3X (0.46) CA12CA1CA2CA9RHOA
SCHEMBL14759757 0.81 CA12 (0.42) CA12CA1CA2CA9SLC16A3
SCHEMBL7632003 0.80 CA12 (0.40) CA12CA1CA2CA9TTR
SCHEMBL17562387 0.79 SNCA (0.49) CA12CA1CA2CA9SNCA
SCHEMBL3657573 0.78 CDK2 (0.45) CA12CA1CA2CA9SNCA
SCHEMBL22713241 0.78 CA1 (0.36) CA12CA1CA2CA9SNCA
SCHEMBL15268433 0.77 CA12 (0.55) CA12CA1CA2CA9
SCHEMBL9272884 0.77 CA12 (0.42) CA12CA1CA2CA9SNCA
SCHEMBL28551801 0.76 CA12 (0.40) CA12CA1CA2CA9SNCA
SCHEMBL7720461 0.76 CDK2 (0.43) CA12CA1CA2CA9SNCA

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-7183093-B2 Mannanases NOVOZYMES A/S (DE) 2007-02-27 US disclosed
US-20030203466-A1 Mannanases NOVOZYMES A/S (DK) 2003-10-30 US 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-20030203466-A1 Mannanases MAN2A1, MANBA, DNASE1L3 CA12 2608/4885CA1 1654/4885CA2 2076/4885

“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.