SCHEMBL15035348

SCHEMBL15035348

C=C(c1ccccc1)c1cc2cnc(Nc3ccc(C4CCNCC4)cc3)nc2n(C2C(=O)c3ccccc3CC2(C)C)c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.43
BRD4 O60885 3/20 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
CDK4 P11802 7/20 0.41
CCND1 P24385 6/20 0.41
FGFR1 P11362 5/20 0.41
FGFR4 P22455 5/20 0.41
CCNA2 P20248 5/20 0.41
CDK2 P24941 5/20 0.41
FGFR2 P21802 4/20 0.41
FGFR3 P22607 4/20 0.41
CSF1R P07333 2/20 0.39
CDK6 Q00534 1/20 0.39
WEE1 P30291 2/20 0.39
BTK Q06187 1/20 0.39
AXL P30530 3/20 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
SCHEMBL15041572 0.93 CDK4 (0.43) JAK2BRD4JAK1BRD2JAK3
SCHEMBL15035552 0.80 CDK4 (0.45) JAK2BRD4JAK1BRD2JAK3
SCHEMBL15035448 0.79 CDK4 (0.41) JAK2BRD4JAK1BRD2JAK3
SCHEMBL15041138 0.77 CDK4 (0.48) CDK4CCND1FGFR1FGFR4CCNA2
SCHEMBL15035546 0.76 CDK4 (0.41) JAK2BRD4JAK3CDK4CCND1
SCHEMBL15035301 0.74 CDK4 (0.40) JAK2BRD4JAK1BRD2JAK3
SCHEMBL15035418 0.74 CDK4 (0.51) JAK2BRD4JAK1BRD2JAK3
SCHEMBL15035513 0.73 WEE1 (0.43) JAK2BRD4JAK3CDK4CCND1
SCHEMBL15041806 0.73 CDK4 (0.52) JAK2BRD4JAK1BRD2JAK3
SCHEMBL15041821 0.73 CDK4 (0.47) JAK2BRD4JAK1BRD2JAK3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 JAK2 720/4885BRD4 1003/4885JAK1 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.