SCHEMBL9967418

SCHEMBL9967418

CNc1cc(-n2nc(C)cc2Nc2cc(NC(=O)c3cccc(C)c3)ccc2C)ncn1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LCK P06239 8/20 0.51
LYN P07948 8/20 0.51
SRC P12931 8/20 0.51
KDR P35968 8/20 0.51
INSR P06213 7/20 0.51
HCK P08631 4/20 0.51
BRAF P15056 5/20 0.45
MAPK14 Q16539 3/20 0.43
MAPT P10636 1/20 0.42
KCNK3 O14649 1/20 0.42
KCNH2 Q12809 1/20 0.42
KCNK9 Q9NPC2 1/20 0.42

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
SCHEMBL9967474 0.91 LCK (0.49) LCKLYNSRCKDRINSR
SCHEMBL3584308 0.89 BRAF (0.45) LCKLYNSRCKDRINSR
SCHEMBL3577332 0.89 LCK (0.56) LCKLYNSRCKDRINSR
SCHEMBL3594891 0.89 LCK (0.47) LCKLYNSRCKDRINSR
SCHEMBL9967414 0.89 LCK (0.56) LCKLYNSRCKDRINSR
SCHEMBL9967475 0.89 LCK (0.48) LCKLYNSRCKDRINSR
SCHEMBL9967420 0.89 LCK (0.51) LCKLYNSRCKDRINSR
SCHEMBL9967419 0.89 LCK (0.65) LCKLYNSRCKDRINSR
SCHEMBL9967421 0.89 LCK (0.52) LCKLYNSRCKDRINSR
SCHEMBL9967413 0.88 LCK (0.56) LCKLYNSRCKDRINSR

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-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US disclosed
US-8202876-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2012-06-19 US disclosed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 US disclosed
US-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-02-04 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-20100029605-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS FYN, ABL2, LCK LCK 3/4885LYN 12/4885SRC 6/4885

“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.