SCHEMBL6134854

SCHEMBL6134854

CCOC1CCN(c2ccc(-c3nn4cc(-c5ccc(C(=O)O)cc5)nc4s3)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.45
MAPT P10636 9/20 0.42
CA12 O43570 7/20 0.42
CA1 P00915 7/20 0.42
CA2 P00918 7/20 0.42
CA9 Q16790 7/20 0.42
GAA P10253 1/20 0.41
CHEK1 O14757 1/20 0.41
USP2 O75604 1/20 0.41
THRB P10828 3/20 0.40

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
SCHEMBL6134575 0.93 TP53 (0.43) TP53MAPTCA12CA1CA2
SCHEMBL6133896 0.91 TP53 (0.42) TP53MAPTCA12CA1CA2
SCHEMBL6135226 0.91 MAPT (0.43) TP53MAPTCA12CA1CA2
SCHEMBL6132169 0.88 MAPT (0.43) TP53MAPTCA12CA1CA2
SCHEMBL6132626 0.86 TP53 (0.46) TP53MAPTCA12CA1CA2
SCHEMBL6134595 0.85 CA12 (0.42) TP53MAPTCA12CA1CA2
SCHEMBL6134951 0.85 CA12 (0.52) TP53MAPTCA12CA1CA2
SCHEMBL6132918 0.85 MAPT (0.40) TP53MAPTCA12CA1CA2
SCHEMBL6134753 0.85 MAPT (0.39) TP53MAPTCA12CA1CA2
SCHEMBL6135143 0.84 MAPT (0.42) TP53MAPTCA12CA1CA2

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-20050261177-A1 Compound ASTELLAS PHARMA INC. (JP) 2005-11-24 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-20050261177-A1 Compound MANBA, MAN2B1, MAN2A1 TP53 3972/4885MAPT 1629/4885CA12 3234/4885

“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.