SCHEMBL15036124

SCHEMBL15036124

CN1CCC(Oc2ccc(Nc3ncc4cc(-c5ccccc5S(=O)(=O)CC(F)(F)F)c(=O)n(Cc5ccccc5C(F)(F)F)c4n3)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 12/20 0.47
SRC P12931 1/20 0.44
CAMK2D Q13557 1/20 0.42
MAP4K3 Q8IVH8 1/20 0.41
MAP4K1 Q92918 1/20 0.41
WEE1 P30291 1/20 0.41
AXL P30530 5/20 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
SCHEMBL13553872 0.80 WEE1 (0.45) TNK2SRCWEE1AXL
SCHEMBL15036076 0.79 TNK2 (0.47) TNK2MAP4K1
SCHEMBL15785317 0.79 AXL (0.47) TNK2SRCCAMK2DMAP4K3MAP4K1
SCHEMBL15036068 0.77 RIPK2 (0.40) TNK2SRCWEE1
SCHEMBL15035972 0.77 TNK2 (0.45) TNK2SRCMAP4K3MAP4K1WEE1
SCHEMBL15036050 0.76 TNK2 (0.48) TNK2SRC
SCHEMBL15041507 0.75 TNK2 (0.44) TNK2MAP4K3MAP4K1WEE1
SCHEMBL14693023 0.74 TNK2 (0.41) TNK2SRCMAP4K3MAP4K1WEE1
SCHEMBL15035747 0.74 TNK2 (0.48) TNK2SRC
SCHEMBL13553751 0.74 TNK2 (0.47) TNK2SRCCAMK2DAXL

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-20130252966-A1 6-(SULFONYLARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS AFRAXIS, INC. (US) 2013-09-26 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-20130252966-A1 6-(SULFONYLARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS PAK2, PAK6, PAK3 TNK2 14/4885SRC 222/4885CAMK2D 78/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 TNK2 7/4885SRC 26/4885CAMK2D 469/4885

“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.