SCHEMBL15036025

SCHEMBL15036025

CN1CCC(Oc2ccc(Nc3ncc4cc(-c5ncc([SH](C)(=O)c6ccncc6)cc5Cl)c(=O)n(CCN(C)S(C)(=O)=O)c4n3)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 5/20 0.41
RIPK2 O43353 5/20 0.41
NOD2 Q9HC29 5/20 0.41
ACVR1 Q04771 4/20 0.41
EGFR P00533 2/20 0.41
WEE1 P30291 1/20 0.40
PAK4 O96013 2/20 0.40
PKN1 Q16512 2/20 0.40
PAK1 Q13153 1/20 0.40
SRC P12931 3/20 0.39
TNK2 Q07912 1/20 0.39
CAMK2D Q13557 1/20 0.39
AXL P30530 4/20 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
SCHEMBL15041506 0.89 RIPK2 (0.42) FGFR1RIPK2NOD2ACVR1EGFR
SCHEMBL15787914 0.78 RIPK2 (0.43) FGFR1RIPK2NOD2ACVR1WEE1
SCHEMBL15041536 0.76 RIPK2 (0.42) FGFR1RIPK2NOD2ACVR1EGFR
SCHEMBL14682001 0.76 RIPK2 (0.47) RIPK2NOD2ACVR1WEE1PAK4
SCHEMBL15036069 0.75 RIPK2 (0.45) FGFR1RIPK2NOD2ACVR1EGFR
SCHEMBL15041707 0.75 RIPK2 (0.43) FGFR1RIPK2NOD2ACVR1EGFR
SCHEMBL14682102 0.74 TNK2 (0.40) FGFR1RIPK2NOD2ACVR1EGFR
SCHEMBL15036122 0.71 RIPK2 (0.47) FGFR1RIPK2NOD2ACVR1SRC
SCHEMBL15785376 0.70 PKN1 (0.44) FGFR1EGFRWEE1PAK4PKN1
SCHEMBL15041286 0.69 TNK2 (0.40) FGFR1RIPK2NOD2ACVR1WEE1

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 FGFR1 1919/4885RIPK2 971/4885NOD2 4628/4885

“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.