SCHEMBL15035102

SCHEMBL15035102

Cc1cc(-c2ccncc2)ncc1-c1cc2cnc(Nc3ccc(OC4CCCN(C)C4)cc3)nc2n(CCN2CCOCC2)c1=O

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 18/20 0.42
SRC P12931 1/20 0.42
PAK4 O96013 1/20 0.40
PKN1 Q16512 1/20 0.40

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
SCHEMBL13553669 0.94 TNK2 (0.47) TNK2SRC
SCHEMBL14682000 0.91 RIPK2 (0.42) TNK2SRCPAK4PKN1
SCHEMBL15036024 0.79 TNK2 (0.48) TNK2SRCPAK4PKN1
SCHEMBL15041508 0.79 TNK2 (0.48) TNK2SRCPAK4PKN1
SCHEMBL15034859 0.78 TNK2 (0.48) TNK2SRC
SCHEMBL15036085 0.77 JAK3 (0.41) TNK2SRC
SCHEMBL14681946 0.77 TNK2 (0.39) TNK2SRCPAK4PKN1
SCHEMBL13553499 0.76 FGFR1 (0.38) TNK2SRCPAK4PKN1
SCHEMBL15041482 0.75 TNK2 (0.42) TNK2SRCPAK4PKN1
SCHEMBL14681967 0.74 PAK3 (0.45) TNK2SRCPAK4PKN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140163026-A1 8-ETHYL-6-(ARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF NERVOUS SYSTEM DISORDERS AND CANCER AFRAXIS HOLDINGS, INC. (US) 2014-06-12 US disclosed
US-20140163026-A1 8-ETHYL-6-(ARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF NERVOUS SYSTEM DISORDERS AND CANCER AFRAXIS HOLDINGS, INC. (US) 2014-06-12 US disclosed
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER AFRAXIS, INC. (US) 2013-06-20 US disclosed
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER AFRAXIS, INC. (US) 2013-06-20 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-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 TNK2 7/4885SRC 26/4885PAK4 5/4885
US-20140163026-A1 8-ETHYL-6-(ARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF NERVOUS SYSTEM DISORDERS AND CANCER PAK2, PAK1, PAK6 TNK2 9/4885SRC 115/4885PAK4 5/4885

“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.