SCHEMBL15041855

SCHEMBL15041855

CC(C)n1c(=O)c(-c2ccc(S(=O)(=O)c3ccncc3)cc2F)cc2cnc(Nc3ccc(OC4CCNCC4)cc3)nc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 6/20 0.39
CCND1 P24385 5/20 0.39
CCNA2 P20248 4/20 0.39
CDK2 P24941 4/20 0.39
ERN1 O75460 2/20 0.38
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
JAK2 O60674 2/20 0.38
JAK3 P52333 1/20 0.38
PTK2 Q05397 1/20 0.38
PLK2 Q9NYY3 2/20 0.37
CDK6 Q00534 1/20 0.37
BRD4 O60885 1/20 0.36
MAPK8 P45983 1/20 0.36
IKBKB O14920 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
SCHEMBL15041887 0.77 FGFR1 (0.38) CDK4CCND1CCNA2CDK2PAK3
SCHEMBL13553721 0.77 CDK4 (0.41) CDK4CCND1CCNA2CDK2PAK1
SCHEMBL13553892 0.76 PKN1 (0.44) CDK4CCND1CCNA2CDK2PAK3
SCHEMBL15785375 0.75 GSK3B (0.46) CDK4CCND1CCNA2CDK2PAK3
SCHEMBL15041721 0.74 MAPK8 (0.46) CDK4CCND1CCNA2CDK2ERN1
SCHEMBL15036056 0.72 PLK2 (0.39) CDK4CCND1CCNA2CDK2JAK2
SCHEMBL15041867 0.70 FGFR1 (0.47) CDK4ERN1PAK3PAK4LIMK1
SCHEMBL16309202 0.70 PAK1 (0.45) CDK4CCND1CCNA2CDK2PAK3
SCHEMBL15281576 0.70 CHEK1 (0.38) CDK4CCND1CCNA2CDK2ROCK1
SCHEMBL15036149 0.70 TNK2 (0.41) CDK4CCND1CCNA2CDK2PAK3

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-8912203-B2 6-(sulfonylaryl)pyrido[2,3-D]pyrimidin-7(8H)-ones for the treatment of CNS disorders AFRAXIS HOLDINGS, INC. (US) 2014-12-16 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 CDK4 404/4885CCND1 2153/4885CCNA2 2011/4885

“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.