SCHEMBL15036092

SCHEMBL15036092

Cc1c(-c2cc3cnc(Nc4ccc(N5CCNCC5)cc4)nc3n(Cc3ccccc3C(F)(F)F)c2=O)cccc1S(C)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 5/20 0.48
JAK2 O60674 4/20 0.48
JAK1 P23458 1/20 0.48
BRD2 P25440 1/20 0.48
JAK3 P52333 1/20 0.48
BRD3 Q15059 1/20 0.48
BRDT Q58F21 1/20 0.48
EGFR P00533 1/20 0.46
PTK2 Q05397 2/20 0.46
CDK4 P11802 7/20 0.45
CCND1 P24385 7/20 0.45
CCND2 P30279 1/20 0.45
CCND3 P30281 1/20 0.45
CCNA2 P20248 5/20 0.45
CDK2 P24941 5/20 0.45
FGFR1 P11362 3/20 0.45
FGFR2 P21802 3/20 0.45
FGFR4 P22455 3/20 0.45
FGFR3 P22607 3/20 0.45
TNK2 Q07912 1/20 0.44

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
SCHEMBL16309191 0.91 JAK2 (0.49) BRD4JAK2JAK1BRD2JAK3
SCHEMBL10192792 0.85 CDK4 (0.51) EGFRPTK2CDK4CCND1CCND2
SCHEMBL13553824 0.81 PTK2 (0.46) EGFRPTK2CDK4CCND1CCND2
SCHEMBL15036034 0.81 TNK2 (0.55) BRD4JAK2TNK2WEE1PAK3
SCHEMBL15785328 0.81 PTK2 (0.44) BRD4JAK2EGFRPTK2CDK4
SCHEMBL10192624 0.81 CDK4 (0.57) EGFRPTK2CDK4CCND1CCND2
SCHEMBL15041674 0.79 PAK1 (0.61) JAK2JAK3PTK2CDK4CCND1
SCHEMBL15281602 0.79 WEE1 (0.56) BRD4JAK2JAK3PTK2CDK4
SCHEMBL10192791 0.78 WEE1 (0.58) PTK2CDK4CCND1CCND2CCND3
SCHEMBL15036002 0.78 TNK2 (0.42) BRD4EGFRPTK2CDK4CCND1

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 4 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
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 BRD4 489/4885JAK2 288/4885JAK1 601/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 BRD4 1003/4885JAK2 720/4885JAK1 1718/4885

“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.