SCHEMBL15035566

SCHEMBL15035566

CCC(CC)c1cc2cnc(Nc3ccc(OC4CCN(C)CC4)cc3)nc2n(C2Cc3ccccc3N(C)S2(=O)=O)c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 1/20 0.45
AXL P30530 5/20 0.40
TNK2 Q07912 8/20 0.40
SRC P12931 2/20 0.40
CCNA2 P20248 3/20 0.38
CDK2 P24941 3/20 0.38
AURKA O14965 1/20 0.38
TTK P33981 1/20 0.38
PDGFRB P09619 2/20 0.37
FGFR1 P11362 2/20 0.37
PDGFRA P16234 1/20 0.37
CDK4 P11802 2/20 0.37
CCND1 P24385 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
ABL1 P00519 1/20 0.37
FYN P06241 1/20 0.37
CDK1 P06493 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
SCHEMBL15035359 0.83 CAMK2D (0.44) CAMK2DAXLTNK2SRCCCNA2
SCHEMBL15035464 0.82 CAMK2D (0.43) CAMK2DAXLTNK2SRCCCNA2
SCHEMBL15035396 0.80 TNK2 (0.48) AXLTNK2SRCEGFR
SCHEMBL15041341 0.74 CDK4 (0.49) TNK2CCNA2CDK2PDGFRBFGFR1
SCHEMBL15034942 0.74 CAMK2D (0.46) CAMK2DAXLTNK2SRCCCNA2
SCHEMBL15035504 0.74 CDK4 (0.44) TNK2SRCCCNA2CDK2PDGFRB
SCHEMBL15041329 0.74 CDK4 (0.52) TNK2CCNA2CDK2AURKAPDGFRB
SCHEMBL15035479 0.73 CDK4 (0.44) TNK2CCNA2CDK2PDGFRBFGFR1
SCHEMBL15035450 0.72 WEE1 (0.42) TNK2CCNA2CDK2PDGFRBFGFR1
SCHEMBL15035911 0.72 CAMK2D (0.45) CAMK2DAXLTNK2SRCCCNA2

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-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 (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 CAMK2D 469/4885AXL 1075/4885TNK2 7/4885

“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.