SCHEMBL15036010

SCHEMBL15036010

O=c1c(-c2ccc(S(=O)(=O)c3ccccc3)cc2C(F)(F)F)cc2cnc(Nc3ccc(NC4CCCNC4)cc3)nc2n1CC1CC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 1/20 0.44
FLT3 P36888 4/20 0.40
CDK4 P11802 1/20 0.40
CCND1 P24385 1/20 0.40
CCND2 P30279 1/20 0.40
CCND3 P30281 1/20 0.40
CCNK O75909 9/20 0.40
CDK12 Q9NYV4 9/20 0.40
CCNT1 O60563 7/20 0.40
CCNE1 P24864 7/20 0.40
CDK2 P24941 7/20 0.40
CDK9 P50750 7/20 0.40
CHEK1 O14757 5/20 0.39
CDK7 P50613 3/20 0.39
CCNH P51946 3/20 0.39
WEE1 P30291 1/20 0.39
MNAT1 P51948 2/20 0.38

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
SCHEMBL15036087 0.82 CHEK1 (0.38) TNK2FLT3CDK4CCND1CCND2
SCHEMBL15041518 0.81 CHEK1 (0.37) FLT3CDK4CCND1CCND2CCND3
SCHEMBL14681988 0.80 PAK1 (0.43) TNK2CDK4CCND1CCND2CCND3
SCHEMBL10246428 0.79 WEE1 (0.44) TNK2FLT3CCNKCDK12CCNT1
SCHEMBL15281046 0.76 TNK2 (0.48) TNK2
SCHEMBL15041890 0.76 TNK2 (0.40) TNK2FLT3CDK4CCND1CCND2
SCHEMBL13553804 0.76 CDK4 (0.46) TNK2CDK4CCND1CCND2CCND3
SCHEMBL13553650 0.76 PAK1 (0.45) TNK2CDK4CCND1CCND2CCND3
SCHEMBL15041669 0.75 PTK2 (0.43) TNK2
SCHEMBL15036037 0.75 TNK2 (0.41) TNK2

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 5 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-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 TNK2 14/4885FLT3 803/4885CDK4 471/4885
US-20130158043-A1 PAK INHIBITORS FOR THE TREATMENT OF CANCER PAK5, PAK2, PAK6 TNK2 7/4885FLT3 811/4885CDK4 404/4885

“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.