SCHEMBL3350167

SCHEMBL3350167

NCc1cccc(-c2c[nH]c3ncccc23)n1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 8/20 0.60
CDK9 P50750 6/20 0.60
CCNT1 O60563 4/20 0.60
CCNA2 P20248 4/20 0.60
CDK2 P24941 4/20 0.60
CDK5 Q00535 3/20 0.60
CCNA1 P78396 1/20 0.60
CDK5R1 Q15078 1/20 0.60
DYRK1A Q13627 4/20 0.54
CCNB2 O95067 4/20 0.52
CDK1 P06493 4/20 0.52
CCNB1 P14635 4/20 0.52
CCNB3 Q8WWL7 4/20 0.52
CDC7 O00311 3/20 0.52
DAPK3 O43293 3/20 0.52
MAP4K4 O95819 3/20 0.52
PIM1 P11309 3/20 0.52
PRKACA P17612 3/20 0.52
CLK2 P49760 3/20 0.52
GSK3B P49841 3/20 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
SCHEMBL1603905 0.80 PDPK1 (0.80) PDPK1CDK9CCNT1CCNA2CDK2
SCHEMBL12321249 0.79 CDK9 (0.58) PDPK1CDK9CCNT1CCNA2CDK2
SCHEMBL12280793 0.77 PDPK1 (0.49) PDPK1CDK9CCNT1CCNA2CDK2
SCHEMBL8942167 0.76 DYRK1A (0.59) PDPK1CDK9CCNT1CCNA2CDK2
SCHEMBL4789520 0.76 PDPK1 (0.58) PDPK1CDK9CCNT1CCNA2CDK2
SCHEMBL12321253 0.76 PDPK1 (0.48) PDPK1CDK9CCNT1CCNA2CDK2
SCHEMBL3350162 0.76 CAMKK2 (0.59) PDPK1CDK9CCNT1CCNA2CDK2
SCHEMBL29364420 0.76 PRKCI (0.63) PDPK1CDK9CCNT1CCNA2CDK2
SCHEMBL25787852 0.76 PRKCI (0.63) PDPK1CDK9CCNT1CCNA2CDK2
SCHEMBL14620845 0.75 CAMKK2 (0.62) PDPK1CDK9CCNT1CCNA2CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180370966-A1 METHODS OF TREATMENT USING PYRIDINONYL PDK1 INHIBITORS SUNESIS PHARMACEUTICALS, INC. 2018-12-27 US disclosed
US-9873693-B2 Methods of treatment using pyridinonyl PDK1 inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2018-01-23 US disclosed
US-8778977-B2 Pyridinonyl PDK1 inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2014-07-15 US disclosed
EP-2038272-B1 PYRIDINONYL PDK1 INHIBITORS SUNESIS PHARMACEUTICALS INC (US) 2013-09-04 EP disclosed
US-20100144730-A1 PYRIDINONYL PDK1 INHIBITORS SUNESIS PHAMACEUTICALS (US) 2010-06-10 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 (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-20180370966-A1 METHODS OF TREATMENT USING PYRIDINONYL PDK1 INHIBITORS PDK1, PDK2, PDK3 PDPK1 6/4885CDK9 341/4885CCNT1 1745/4885
US-20100144730-A1 PYRIDINONYL PDK1 INHIBITORS PDK1, PDK2, PDK3 PDPK1 5/4885CDK9 98/4885CCNT1 1510/4885

“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.