SCHEMBL15035293

SCHEMBL15035293

CN1CCN(c2ccc(Nc3ncc4cc(N(C)c5ccccc5)c(=O)n(C5CNc6ccccc6C5)c4n3)cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 12/20 0.51
CCND1 P24385 11/20 0.51
CDK2 P24941 9/20 0.51
CCNA2 P20248 7/20 0.51
FGFR1 P11362 7/20 0.51
CCNE1 P24864 5/20 0.51
CDK1 P06493 2/20 0.51
CCNB1 P14635 2/20 0.51
CDK6 Q00534 2/20 0.51
PIK3CD O00329 1/20 0.51
PRKAB2 O43741 1/20 0.51
NUAK1 O60285 1/20 0.51
CCNT1 O60563 1/20 0.51
ABL1 P00519 1/20 0.51
FYN P06241 1/20 0.51
CSF1R P07333 1/20 0.51
RET P07949 1/20 0.51
PDGFRB P09619 1/20 0.51
MARK3 P27448 1/20 0.51
FLT3 P36888 1/20 0.51

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
SCHEMBL15035277 0.83 FGFR1 (0.58) CDK4CCND1CDK2CCNA2FGFR1
SCHEMBL15041559 0.83 CDK4 (0.71) CDK4CCND1CDK2CCNA2FGFR1
SCHEMBL15035475 0.82 CDK4 (0.52) CDK4CCND1CDK2CCNA2FGFR1
SCHEMBL16510433 0.82 PAK1 (0.64) CDK4CCND1CDK2CCNA2FGFR1
SCHEMBL15035275 0.81 PAK1 (0.55) CDK4CCND1CDK2CCNA2FGFR1
SCHEMBL15035532 0.76 CDK4 (0.44) CDK4CCND1CDK2CCNA2FGFR1
SCHEMBL15035510 0.76 WEE1 (0.43) CDK4CCND1CDK2CCNA2PKN1
SCHEMBL15035315 0.76 CDK4 (0.44) CDK4CCND1CDK2CCNA2FGFR1
SCHEMBL15041817 0.74 CDK4 (0.58) CDK4CCND1CDK2CCNA2FGFR1
SCHEMBL15041309 0.74 CDK4 (0.49) CDK4CCND1CDK2CCNA2FGFR1

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-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 (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 CDK4 404/4885CCND1 2153/4885CDK2 183/4885

“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.