SCHEMBL5332048

SCHEMBL5332048

CN(C)CCC(=O)Nc1ccc2[nH]c3ccc(NC(=O)CCN(C)C)cc3c(=O)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TERT O14746 16/20 1.00
P2RY12 Q9H244 2/20 0.67
TNKS O95271 1/20 0.54
PARP1 P09874 1/20 0.54
PARP15 Q460N3 1/20 0.54
PARP14 Q460N5 1/20 0.54
PARP10 Q53GL7 1/20 0.54
PARP12 Q9H0J9 1/20 0.54
TNKS2 Q9H2K2 1/20 0.54
PARP2 Q9UGN5 1/20 0.54
PARP4 Q9UKK3 1/20 0.54
PARP3 Q9Y6F1 1/20 0.54
TRPM2 O94759 1/20 0.52

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
SCHEMBL5337682 0.89 TERT (1.00) TERTP2RY12
SCHEMBL25811358 0.84 TERT (0.73) TERTP2RY12TNKSPARP1PARP15
SCHEMBL5333828 0.82 P2RY12 (0.72) TERTP2RY12
SCHEMBL5344753 0.77 P2RY12 (0.70) TERTP2RY12
SCHEMBL10068096 0.76 P2RY12 (0.90) TERTP2RY12
SCHEMBL5337185 0.76 TERT (1.00) TERTP2RY12
SCHEMBL14355586 0.76 TERT (1.00) TERTP2RY12
SCHEMBL5337897 0.75 TERT (1.00) TERTP2RY12
SCHEMBL5339895 0.74 TERT (1.00) TERTP2RY12
SCHEMBL8700991 0.74 TERT (1.00) TERT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7300930-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2007-11-27 US disclosed
US-7300930-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2007-11-27 US disclosed
US-7300930-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2007-11-27 US disclosed
US-7160896-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2007-01-09 US disclosed
US-7160896-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2007-01-09 US disclosed
US-7160896-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2007-01-09 US disclosed
US-20060111389-A1 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2006-05-25 US disclosed
EP-1363888-A2 THERAPEUTIC ACRIDONE AND ACRIDINE COMPOUNDS Cancer Research Technology Limited (GB) 2003-11-26 EP disclosed
US-20030207909-A1 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2003-11-06 US disclosed
WO-2002008193-A2 THERAPEUTIC ACRIDONE AND ACRIDINE COMPOUNDS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2002-01-31 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 (2 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-20030207909-A1 Therapeutic acridone and acridine compounds NAT1, TERT, CCNA1 TERT 2/4885P2RY12 4624/4885TNKS 155/4885
US-20060111389-A1 Therapeutic acridone and acridine compounds TERT, ACIN1, NAT1 TERT 1/4885P2RY12 3821/4885TNKS 141/4885

“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.