SCHEMBL6450078

SCHEMBL6450078

Cc1cn(-c2cc(C(=O)Nc3ccc(C)c(NC(=O)n4ccc5c(Nc6cccc(S(N)(=O)=O)c6)ncnc54)c3)cc(C(F)(F)F)c2)cn1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.55
POLB P06746 1/20 0.55
RECQL P46063 1/20 0.55
CSF1R P07333 1/20 0.53
MAPT P10636 1/20 0.52
RAF1 P04049 5/20 0.48
BRAF P15056 5/20 0.48
SRC P12931 3/20 0.47
NTRK1 P04629 2/20 0.47
AURKA O14965 1/20 0.47
NTRK2 Q16620 1/20 0.47
ABL1 P00519 5/20 0.47
EPHB4 P54760 1/20 0.46
LCK P06239 2/20 0.45
LYN P07948 2/20 0.45
HCK P08631 2/20 0.45
INSR P06213 1/20 0.45
KDR P35968 1/20 0.45
BCR P11274 3/20 0.44
EGFR P00533 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
SCHEMBL14216517 0.92 KDM4E (0.57) KDM4EPOLBRECQLCSF1RMAPT
SCHEMBL6450942 0.92 KDM4E (0.57) KDM4EPOLBRECQLCSF1RMAPT
SCHEMBL6451135 0.92 KDM4E (0.58) KDM4EPOLBRECQLCSF1RMAPT
SCHEMBL6450027 0.91 KDM4E (0.55) KDM4EPOLBRECQLCSF1RMAPT
SCHEMBL6450014 0.91 KDM4E (0.57) KDM4EPOLBRECQLCSF1RMAPT
SCHEMBL6454468 0.90 KDM4E (0.56) KDM4EPOLBRECQLCSF1RMAPT
SCHEMBL6455329 0.90 KDM4E (0.56) KDM4EPOLBRECQLCSF1RMAPT
SCHEMBL6450943 0.90 KDM4E (0.56) KDM4EPOLBRECQLCSF1RMAPT
SCHEMBL6450370 0.89 KDM4E (0.55) KDM4EPOLBRECQLCSF1RMAPT
SCHEMBL6455040 0.89 KDM4E (0.55) KDM4EPOLBRECQLCSF1RMAPT

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-20050159391-A1 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2005-07-21 US claimed
US-20080108616-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-05-08 US disclosed
US-20080108616-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-05-08 US disclosed
US-7338957-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2008-03-04 US disclosed
US-20050159391-A1 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2005-07-21 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-20080108616-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS LCK, FYN, BMX KDM4E 3165/4885POLB 4460/4885RECQL 3252/4885
US-20050159391-A1 Compounds and compositions as protein kinase inhibitors LCK, FYN, BMX KDM4E 3165/4885POLB 4460/4885RECQL 3252/4885

“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.