SCHEMBL800775

SCHEMBL800775

CCCc1oc2nc1-c1nc(co1)-c1nc(co1)-c1nc(co1)C(=O)NC(COCc1ccccc1)c1nc(co1)-c1nc(co1)-c1nc-2co1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TERT O14746 4/20 0.44
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
CDC7 O00311 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL10045784 0.91 TERT (0.42) TERT
SCHEMBL800969 0.90 TERT (0.44) TERTCDC7LMNA
SCHEMBL10045793 0.77 TERT (0.43) TERTCDC7LMNA
SCHEMBL801051 0.73 TERT (0.37) TERT
SCHEMBL10073153 0.68 TERT (0.55) TERT
SCHEMBL13587916 0.61 TERT (1.00) TERT
SCHEMBL800988 0.59
SCHEMBL805174 0.58 TERT (0.51) TERTCDC7
SCHEMBL10045778 0.57 TERT (0.48) TERT
SCHEMBL5111340 0.57 PPARA (0.47)

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-8518928-B2 Therapeutic compounds RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2013-08-27 US disclosed
US-20120071527-A1 THERAPEUTIC COMPOUNDS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2012-03-22 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-20120071527-A1 THERAPEUTIC COMPOUNDS TOP2B, DDB1, TOP1 TERT 141/4885ADORA2A 1226/4885ADORA1 758/4885

“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.