SCHEMBL15034898

SCHEMBL15034898

CC(C)C(=O)c1cc2cnc(Nc3ccc(N4C[C@@H](C)N[C@@H](C)C4)c(F)c3)nc2n(Cc2ccncc2C2CCOCC2)c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 9/20 0.41
FGFR1 P11362 3/20 0.39
FGFR4 P22455 3/20 0.39
KDR P35968 1/20 0.39
PAK3 O75914 1/20 0.38
PAK4 O96013 1/20 0.38
LIMK1 P53667 1/20 0.38
LIMK2 P53671 1/20 0.38
PAK1 Q13153 1/20 0.38
PAK2 Q13177 1/20 0.38
PKN1 Q16512 1/20 0.38
SYK P43405 2/20 0.36
TNK2 Q07912 1/20 0.36
CDK4 P11802 4/20 0.36
CCND1 P24385 3/20 0.36
CCNT1 O60563 2/20 0.36
CDK9 P50750 2/20 0.36
CCNA2 P20248 2/20 0.36
FGFR2 P21802 2/20 0.36
FGFR3 P22607 2/20 0.36

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
SCHEMBL15237014 0.95 JAK3 (0.41) JAK3FGFR1FGFR4KDRPAK3
SCHEMBL15041756 0.93 JAK3 (0.42) JAK3FGFR1FGFR4KDRPAK3
SCHEMBL15277164 0.83 FGFR1 (0.39) JAK3FGFR1FGFR4KDRPAK3
SCHEMBL15041211 0.81 PAK3 (0.41) JAK3FGFR1FGFR4KDRPAK3
SCHEMBL15034971 0.80 PAK3 (0.39) JAK3FGFR1FGFR4KDRPAK3
SCHEMBL15041379 0.80 PAK3 (0.52) JAK3FGFR1FGFR4PAK3PAK4
SCHEMBL15041754 0.80 JAK3 (0.39) JAK3FGFR1FGFR4KDRPAK3
SCHEMBL15041628 0.79 FGFR1 (0.40) JAK3FGFR1FGFR4KDRPAK3
SCHEMBL15280098 0.79 FGFR1 (0.40) JAK3FGFR1FGFR4KDRPAK3
SCHEMBL15034857 0.78 JAK3 (0.39) JAK3FGFR1FGFR4KDRPAK3

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 JAK3 1901/4885FGFR1 1919/4885FGFR4 1949/4885

“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.