SCHEMBL15035928

SCHEMBL15035928

C=C(c1cc2cnc(Nc3ccc(N4CCNCC4)cc3)nc2n(Cc2nccn2S(=O)(=O)c2ccccc2)c1=O)C(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR4 P22455 10/20 0.49
CDK4 P11802 11/20 0.47
CCND1 P24385 11/20 0.47
CCNA2 P20248 8/20 0.47
CDK2 P24941 8/20 0.47
FGFR1 P11362 6/20 0.47
FGFR2 P21802 6/20 0.47
FGFR3 P22607 6/20 0.47
BRD4 O60885 2/20 0.43
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
BRD2 P25440 1/20 0.43
JAK3 P52333 1/20 0.43
BRD3 Q15059 1/20 0.43
BRDT Q58F21 1/20 0.43
CCND2 P30279 3/20 0.43
CCND3 P30281 3/20 0.43
WEE1 P30291 1/20 0.41
STAT6 P42226 1/20 0.41
MAPK8 P45983 1/20 0.41

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
SCHEMBL15041467 0.93 FGFR4 (0.50) FGFR4CDK4CCND1CCNA2CDK2
SCHEMBL15035840 0.77 CDK4 (0.46) FGFR4CDK4CCND1CCNA2CDK2
SCHEMBL15034988 0.75 CDK4 (0.51) FGFR4CDK4CCND1CCNA2CDK2
SCHEMBL15035067 0.74 CDK4 (0.51) FGFR4CDK4CCND1CCNA2CDK2
SCHEMBL15034864 0.74 CDK4 (0.52) FGFR4CDK4CCND1CCNA2CDK2
SCHEMBL16570963 0.73 FGFR4 (0.79) FGFR4CDK4CCND1CCNA2CDK2
SCHEMBL15035717 0.73 CDK4 (0.44) FGFR4CDK4CCND1CCNA2CDK2
SCHEMBL15035583 0.72 CDK4 (0.54) FGFR4CDK4CCND1CCNA2CDK2
SCHEMBL15035725 0.72 TNK2 (0.42) FGFR4CDK4CCND1CCNA2CDK2
SCHEMBL15035380 0.71 CDK4 (0.55) FGFR4CDK4CCND1CCNA2CDK2

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-20130252967-A1 8-(SULFONYLBENZYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS AFRAXIS, INC. (US) 2013-09-26 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 (2 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-20130252967-A1 8-(SULFONYLBENZYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS PAK2, PAK3, PAK6 FGFR4 2162/4885CDK4 441/4885CCND1 4422/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 FGFR4 1949/4885CDK4 404/4885CCND1 2153/4885

“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.