SCHEMBL1592677

SCHEMBL1592677

N#CCNCc1cc(-c2ccnc(NC3CCCCC3)c2)nc(N2CCNCC2)c1

nearest known ligand 0.72

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PRKD1 Q15139 20/20 0.72
PRKD2 Q9BZL6 14/20 0.72
ADRB1 P08588 2/20 0.61
PRKCA P17252 1/20 0.54
PRKCD Q05655 1/20 0.54

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
SCHEMBL1578884 0.90 PRKD1 (0.76) PRKD1PRKD2ADRB1PRKCAPRKCD
SCHEMBL7960000 0.88 PRKD1 (0.67) PRKD1PRKD2ADRB1PRKCAPRKCD
SCHEMBL1592068 0.85 PRKD1 (0.71) PRKD1PRKD2ADRB1PRKCAPRKCD
SCHEMBL1578866 0.85 PRKD1 (0.71) PRKD1PRKD2ADRB1PRKCAPRKCD
SCHEMBL7959994 0.85 PRKD1 (0.71) PRKD1PRKD2ADRB1PRKCAPRKCD
SCHEMBL1578818 0.84 PRKD1 (1.00) PRKD1PRKD2ADRB1PRKCAPRKCD
SCHEMBL12723819 0.83 PRKD1 (0.52) PRKD1PRKD2ADRB1
SCHEMBL1579274 0.81 PRKD1 (0.75) PRKD1PRKD2ADRB1
SCHEMBL1579167 0.81 PRKD1 (0.76) PRKD1PRKD2ADRB1PRKCAPRKCD
SCHEMBL1578895 0.80 PRKD1 (0.74) PRKD1PRKD2ADRB1PRKCAPRKCD

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 2 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

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 PRKD1 4750/4885PRKD2 4659/4885ADRB1 880/4885

“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.