SCHEMBL15041700

SCHEMBL15041700

CN1CCC(Nc2ccc(Nc3ncc4cc(-c5ccc(S(=O)(=O)C6CCN(C)CC6)cn5)c(=O)n(C5CCOC5)c4n3)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 14/20 0.41
CCND1 P24385 13/20 0.41
CCNE1 P24864 11/20 0.41
CDK4 P11802 8/20 0.41
CDK6 Q00534 8/20 0.41
CCNA2 P20248 5/20 0.41
FGFR1 P11362 5/20 0.41
CDK9 P50750 4/20 0.41
CCNT1 O60563 3/20 0.41
CDK1 P06493 3/20 0.41
CCNB1 P14635 2/20 0.41
PDGFRB P09619 2/20 0.41
PIK3CD O00329 1/20 0.41
PRKAB2 O43741 1/20 0.41
NUAK1 O60285 1/20 0.41
ABL1 P00519 1/20 0.41
FYN P06241 1/20 0.41
CSF1R P07333 1/20 0.41
RET P07949 1/20 0.41
MARK3 P27448 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
SCHEMBL15041694 0.80 CCND1 (0.40) CDK2CCND1CCNE1CDK4CDK6
SCHEMBL15787837 0.79 LCK (0.42) CDK2CCND1CCNE1CDK4CDK6
SCHEMBL15041864 0.77 CDK4 (0.46) CDK2CCND1CCNE1CDK4CDK6
SCHEMBL14682041 0.76 TNK2 (0.40) CDK2CCND1CCNE1CDK4CDK6
SCHEMBL15036012 0.76 CCND1 (0.40) CDK2CCND1CCNE1CDK4CDK6
SCHEMBL15041499 0.74 CAMK2D (0.40) CDK2CCND1CCNE1CDK4CDK6
SCHEMBL13553647 0.73 PAK4 (0.37) CDK2CCND1CCNE1CDK4CDK6
SCHEMBL15041528 0.73 STK3 (0.40) CDK2CCND1CCNE1CDK4CDK6
SCHEMBL15041697 0.72 PAK1 (0.53) CDK2CCND1CCNE1CDK4CDK6
SCHEMBL15036150 0.72 CDK4 (0.38) CDK2CCND1CDK4CDK6CCNA2

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 3 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-20130252966-A1 6-(SULFONYLARYL)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-20130252966-A1 6-(SULFONYLARYL)PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONES FOR THE TREATMENT OF CNS DISORDERS PAK2, PAK6, PAK3 CDK2 226/4885CCND1 4379/4885CCNE1 4426/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 CDK2 183/4885CCND1 2153/4885CCNE1 1585/4885

“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.