SCHEMBL6134933

SCHEMBL6134933

O=C(O)c1ccc(-c2cn3nc(-c4ccc(OC5CCN(C6CCCCC6)CC5)cc4)sc3n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 15/20 0.48
KCNH2 Q12809 4/20 0.44
TP53 P04637 1/20 0.44
EPHX2 P34913 1/20 0.44
CA12 O43570 3/20 0.43
CA1 P00915 3/20 0.43
CA2 P00918 3/20 0.43
CA9 Q16790 3/20 0.43
ADRA1A P35348 1/20 0.42

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
SCHEMBL7313043 0.92 TP53 (0.50) TP53EPHX2CA12CA1CA2
SCHEMBL6134926 0.88 HRH3 (0.46) HRH3KCNH2TP53CA12CA1
Hydrochloric Acid SCHEMBL6132465 0.85 TP53 (0.46) HRH3TP53CA12CA1CA2
SCHEMBL6134517 0.85 TP53 (0.50) KCNH2TP53EPHX2CA12CA1
SCHEMBL6134689 0.84 CA12 (0.40) HRH3TP53CA12CA1CA2
SCHEMBL6135285 0.83 EPHX2 (0.52) HRH3KCNH2EPHX2ADRA1A
SCHEMBL6134951 0.82 CA12 (0.52) TP53CA12CA1CA2CA9
SCHEMBL6133887 0.82 HDAC3 (0.42) HRH3KCNH2TP53CA12CA1
Trifluoroacetic Acid SCHEMBL6937886 0.82 TP53 (0.42) HRH3TP53CA12CA1CA2
SCHEMBL6134934 0.81 MKNK1 (0.47) HRH3KCNH2EPHX2

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 HRH3 1440/4885KCNH2 2774/4885TP53 3972/4885

“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.