SCHEMBL5335867

SCHEMBL5335867

Nc1ccc2c(=O)c3cc(N)ccc3[nH]c2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.59
KIF11 P52732 2/20 0.51
CDK4 P11802 1/20 0.51
CCND1 P24385 1/20 0.51
CA12 O43570 1/20 0.49
CA9 Q16790 1/20 0.49
AR P10275 2/20 0.47
NGFR P08138 1/20 0.47
GAA P10253 3/20 0.47
MEN1 O00255 2/20 0.47
POLB P06746 2/20 0.47
KMT2A Q03164 2/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
GLA P06280 2/20 0.47
HTT P42858 2/20 0.47
NPC1 O15118 2/20 0.47
CASP6 P55212 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47

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
SCHEMBL31473178 1.00 PARP1 (0.59) PARP1KIF11CDK4CCND1CA12
SCHEMBL25791861 0.92 PARP1 (0.55) PARP1KIF11CDK4CCND1CA12
SCHEMBL31312450 0.92 PARP1 (0.62) PARP1KIF11CDK4CCND1CA12
SCHEMBL5332607 0.92 PARP1 (0.62) PARP1KIF11CDK4CCND1CA12
SCHEMBL5342370 0.92 PARP1 (0.58) PARP1KIF11CDK4CCND1CA12
SCHEMBL29360002 0.87 GAA (0.67) PARP1CDK4CCND1CA12CA9
SCHEMBL354414 0.87 GAA (0.67) PARP1CDK4CCND1CA12CA9
SCHEMBL29423967 0.87 GAA (0.67) PARP1CDK4CCND1CA12CA9
SCHEMBL6325907 0.87 CDK4 (0.69) PARP1KIF11CDK4CCND1AR
SCHEMBL30975189 0.84 KIF11 (0.68) PARP1KIF11CDK4CCND1CA12

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-7205311-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED 2007-04-17 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
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 (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-20060111389-A1 Therapeutic acridone and acridine compounds TERT, ACIN1, NAT1 PARP1 118/4885KIF11 2368/4885CDK4 95/4885

“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.