SCHEMBL7956048

SCHEMBL7956048

NC1CCN(c2cccc(-c3ccnc(NC4CCCCC4)c3)n2)CC1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KARS1 Q15046 2/20 0.57
PRKD1 Q15139 14/20 0.55
PRKD2 Q9BZL6 10/20 0.55
ADRB1 P08588 1/20 0.54
CCNT1 O60563 4/20 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
SCHEMBL1579219 0.87 PRKD1 (0.71) KARS1PRKD1PRKD2ADRB1
SCHEMBL1579182 0.86 PRKD1 (0.65) PRKD1PRKD2ADRB1
SCHEMBL1579619 0.84 PRKD1 (0.59) PRKD1PRKD2ADRB1CCNT1
SCHEMBL1592056 0.81 PRKD1 (0.81) PRKD1PRKD2ADRB1
SCHEMBL1580957 0.78 PRKD1 (0.55) PRKD1PRKD2ADRB1CCNT1
SCHEMBL1192258 0.77 CCNT1 (0.55) KARS1PRKD1PRKD2CCNT1
SCHEMBL1192376 0.77 CCNT1 (0.72) CCNT1
SCHEMBL1579448 0.76 PRKD1 (0.69) KARS1PRKD1PRKD2ADRB1CCNT1
SCHEMBL7948438 0.74 PRKD1 (0.75) PRKD1PRKD2ADRB1CCNT1
SCHEMBL12898597 0.74 CCNT1 (0.61) PRKD1PRKD2CCNT1

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-20110092505-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-04-21 US disclosed
US-20110092505-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-04-21 US disclosed
WO-2009150230-A1 2,4'-BIPYRIDINYL COMPOUNDS AS PROTEIN KINASE D INHIBITORS USEFUL FOR THE TREATMENT OF IA HEART FAILURE AND CANCER NOVARTIS AG (CH) 2009-12-17 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-20110092505-A1 ORGANIC COMPOUNDS SLCO2B1, SLCO1B1, SLCO1B3 KARS1 3287/4885PRKD1 4750/4885PRKD2 4659/4885

“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.