SCHEMBL23130692

SCHEMBL23130692

Cc1cc(=O)[nH]c2cc(NC(=O)CN(CCN(CCN(CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)CCN(CC(=O)OC(C)(C)C)CC(=O)OC(C)(C)C)ccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 4/20 0.43
▸ HPGD P15428 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ KDM4E B2RXH2 5/20 0.39
▸ GLA P06280 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ ALDH1A1 P00352 4/20 0.38
▸ PPARA Q07869 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ TNKS O95271 1/20 0.36
▸ PARP1 P09874 1/20 0.36
▸ PARP15 Q460N3 1/20 0.36
▸ PARP14 Q460N5 1/20 0.36
▸ PARP10 Q53GL7 1/20 0.36
▸ PARP12 Q9H0J9 1/20 0.36
▸ TNKS2 Q9H2K2 1/20 0.36

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
SCHEMBL23130691 0.89 AR (0.53) AR
SCHEMBL23130695 0.87 TERT (0.37) TERTHPGDLMNACYP2C9CA12
SCHEMBL14367687 0.85 TERT (0.48) TERTHPGDLMNACYP2C9CA12
SCHEMBL23130696 0.85 TERT (0.35) TERTHPGDLMNACYP2C9ALDH1A1
SCHEMBL13273544 0.80 CA1 (0.46) TERTHPGDLMNACYP2C9CA12
SCHEMBL23130701 0.77 AR (0.49) AR
SCHEMBL23130702 0.76 AR (0.47) AR
SCHEMBL10056890 0.74 KDM4E (0.64) TERTHPGDLMNACYP2C9KDM4E
SCHEMBL7923976 0.74 KDM4E (0.53) TERTHPGDLMNACYP2C9KDM4E
SCHEMBL10001927 0.74 TERT (0.40) TERTCA12CA1CA9

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-10961197-B2 Metal chelators for imaging, therapeutics, and bioanalysis THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2021-03-30 — — 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-10961197-B2 Metal chelators for imaging, therapeutics, and bioanalysis TBCA, SLC39A3, TBL3 TERT 1814/4885HPGD 2898/4885LMNA 2339/4885

“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