SCHEMBL2069375

SCHEMBL2069375

Cc1nc(N2CCC(O)C2)ccc1N

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMPD3 Q9NY59 6/20 0.46
METAP2 P50579 2/20 0.46
CCNT1 O60563 1/20 0.41
CDK4 P11802 1/20 0.41
CCND1 P24385 1/20 0.41
CDK9 P50750 1/20 0.41
CDK6 Q00534 1/20 0.41
CDK11A Q9UQ88 1/20 0.41
PDE10A Q9Y233 3/20 0.40
PRKDC P78527 1/20 0.38
CDK1 P06493 1/20 0.38
CDK2 P24941 1/20 0.38
IKBKB O14920 3/20 0.38

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
SCHEMBL2068649 1.00 SMPD3 (0.46) SMPD3METAP2CCNT1CDK4CCND1
SCHEMBL2069373 1.00 SMPD3 (0.46) SMPD3METAP2CCNT1CDK4CCND1
SCHEMBL2411684 0.84 SMPD3 (0.48) SMPD3METAP2PDE10APRKDCCDK1
SCHEMBL14938741 0.83 MAP4K4 (0.40) SMPD3PDE10A
SCHEMBL2413653 0.83 SMPD3 (0.47) SMPD3METAP2PDE10APRKDCCDK1
Hydrochloric Acid SCHEMBL6336102 0.83 SMPD3 (0.47) SMPD3METAP2PDE10APRKDCCDK1
SCHEMBL15515890 0.82 METAP2 (0.46) SMPD3METAP2CCNT1CDK4CCND1
SCHEMBL15509173 0.82 METAP2 (0.46) SMPD3METAP2CCNT1CDK4CCND1
SCHEMBL15509072 0.82 METAP2 (0.46) SMPD3METAP2CCNT1CDK4CCND1
SCHEMBL2411465 0.81 PRKAB2 (0.48) SMPD3PDE10APRKDCIKBKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2438063-A1 1H-IMIDAZO[4,5-C]QUINOLINONE COMPOUNDS, USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES Novartis AG (CH) 2012-04-11 EP disclosed
WO-2010139747-A1 1H-IMIDAZO[4, 5-c]QUINOLINONE COMPOUNDS, USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES NOVARTIS AG (CH) 2010-12-09 WO disclosed
WO-2010139747-A1 1H-IMIDAZO[4, 5-c]QUINOLINONE COMPOUNDS, USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES NOVARTIS AG (CH) 2010-12-09 WO disclosed
US-20100311714-A1 1H-IMIDAZO[4,5-c]QUINOLINONE COMPOUNDS NOVARTIS AG (CH) 2010-12-09 US disclosed
US-20100311714-A1 1H-IMIDAZO[4,5-c]QUINOLINONE COMPOUNDS NOVARTIS AG (CH) 2010-12-09 US disclosed
US-20100311714-A1 1H-IMIDAZO[4,5-c]QUINOLINONE COMPOUNDS NOVARTIS AG (CH) 2010-12-09 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-20100311714-A1 1H-IMIDAZO[4,5-c]QUINOLINONE COMPOUNDS PRKCA, ABL1, MYLK2 SMPD3 1264/4885METAP2 4283/4885CCNT1 3291/4885

“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.