SCHEMBL15041356

SCHEMBL15041356

CN1CCCC(Oc2ccc(Nc3ncc4cc(C(=O)C5CCOCC5)c(=O)n(C5CCc6ccccc6C5=O)c4n3)cc2)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 4/20 0.40
SRC P12931 2/20 0.40
CAMK2D Q13557 1/20 0.39
CDK4 P11802 6/20 0.39
CCND1 P24385 6/20 0.39
CCNA2 P20248 5/20 0.39
CDK2 P24941 5/20 0.39
FGFR1 P11362 5/20 0.39
FGFR2 P21802 3/20 0.39
FGFR4 P22455 3/20 0.39
FGFR3 P22607 3/20 0.39
AXL P30530 5/20 0.38
CCNE1 P24864 3/20 0.37
CDK1 P06493 2/20 0.37
CCNB1 P14635 2/20 0.37
PDGFRB P09619 2/20 0.37
PIK3CD O00329 1/20 0.37
PRKAB2 O43741 1/20 0.37
NUAK1 O60285 1/20 0.37
CCNT1 O60563 1/20 0.37

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
SCHEMBL15035527 0.93 TNK2 (0.40) TNK2SRCCAMK2DCDK4CCND1
SCHEMBL15041304 0.85 TNK2 (0.40) TNK2SRCCAMK2DCDK4CCND1
SCHEMBL15041310 0.84 CDK4 (0.40) TNK2SRCCAMK2DCDK4CCND1
SCHEMBL15041579 0.81 CAMK2D (0.42) TNK2SRCCAMK2DCDK4CCND1
SCHEMBL15035316 0.81 TNK2 (0.45) TNK2SRCCAMK2DAXLEGFR
SCHEMBL15041585 0.81 CDK2 (0.39) TNK2SRCCAMK2DCDK4CCND1
SCHEMBL15041293 0.81 CAMK2D (0.40) TNK2SRCCAMK2DCDK4CCND1
SCHEMBL15035426 0.78 TNK2 (0.40) TNK2SRCCAMK2DCDK4CCND1
SCHEMBL15035312 0.77 CDK4 (0.39) TNK2SRCCAMK2DCDK4CCND1
SCHEMBL15041575 0.77 CDK2 (0.40) TNK2SRCCAMK2DCDK4CCND1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-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.