SCHEMBL10035653

SCHEMBL10035653

Cc1cc(=O)[nH]c2cc(NC(=O)CN(CCN3CCOCCN(CCN(CC(=O)O)CC(=O)O)CC3)CC(=O)O)ccc12

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 9/20 0.54
▸ TNKS2 Q9H2K2 1/20 0.46
▸ TSHR P16473 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ PAK1 Q13153 1/20 0.40
▸ ATM Q13315 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ PIK3CD O00329 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ AKT1 P31749 1/20 0.39
▸ PIK3CA P42336 1/20 0.39
▸ PIK3CB P42338 1/20 0.39
▸ PIK3CG P48736 1/20 0.39

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
SCHEMBL10035654 0.99 TERT (0.55) TERTTNKS2TSHRLMNAALOX15
SCHEMBL10001931 0.94 TERT (0.51) TERTTNKS2TSHRLMNAALOX15
SCHEMBL10001935 0.93 TERT (0.47) TERTTNKS2TSHRLMNAALOX15
SCHEMBL10001921 0.92 TERT (0.48) TERTTNKS2TSHRLMNAALOX15
SCHEMBL10001934 0.89 TERT (0.49) TERTTNKS2TSHRALOX15PAK1
SCHEMBL10035606 0.86 TERT (0.52) TERTTNKS2TSHRPAK1RAB9A
SCHEMBL10001923 0.85 TERT (0.41) TERTTNKS2TSHRLMNAALOX15
SCHEMBL14367687 0.84 TERT (0.48) TERTLMNA
SCHEMBL10001924 0.84 TERT (0.41) TERTTNKS2TSHRLMNAALOX15
SCHEMBL14530618 0.83 TERT (0.39) TERTTNKS2TSHRLMNAALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8110404-B2 Luminescent lanthanide binding chelates BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-02-07 — — US disclosed
US-20080299675-A1 Luminescent Lanthanide Binding Chelates BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2008-12-04 — — US disclosed
WO-2007055700-A1 LUMINESCENT LANTHANIDE BINDING CHELATES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2007-05-18 — — 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-20080299675-A1 Luminescent Lanthanide Binding Chelates HLCS, LYAR, SLC6A13 TERT 2908/4885TNKS2 3224/4885TSHR 512/4885

“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.

Send feedback