SCHEMBL2960099

SCHEMBL2960099

COCCCN1CCN(C2CCC(n3nc(I)c4c(N)ncnc43)CC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 10/20 0.55
▸ LCK P06239 8/20 0.55
▸ KDR P35968 3/20 0.55
▸ JAK2 O60674 3/20 0.55
▸ FYN P06241 2/20 0.55
▸ RET P07949 2/20 0.55
▸ CDC7 O00311 1/20 0.55
▸ PLK4 O00444 1/20 0.55
▸ DYRK3 O43781 1/20 0.55
▸ PRKD3 O94806 1/20 0.55
▸ MAP4K4 O95819 1/20 0.55
▸ NTRK1 P04629 1/20 0.55
▸ INSR P06213 1/20 0.55
▸ CDK1 P06493 1/20 0.55
▸ ROS1 P08922 1/20 0.55
▸ FER P16591 1/20 0.55
▸ PRKACA P17612 1/20 0.55
▸ RPS6KB1 P23443 1/20 0.55
▸ CDK2 P24941 1/20 0.55
▸ MARK3 P27448 1/20 0.55

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
SCHEMBL4818639 0.86 SRC (0.59) SRCLCKKDRJAK2FYN
SCHEMBL23847532 0.83 LCK (0.67) SRCLCKKDRJAK2FYN
SCHEMBL760441 0.83 LCK (0.67) SRCLCKKDRJAK2FYN
SCHEMBL760440 0.83 LCK (0.67) SRCLCKKDRJAK2FYN
SCHEMBL2960034 0.83 LCK (0.67) SRCLCKKDRJAK2FYN
SCHEMBL4976789 0.80 EGFR (0.48) SRCLCKKDRJAK2EGFR
SCHEMBL4818634 0.80 JAK2 (0.54) SRCLCKKDRJAK2FYN
SCHEMBL6107749 0.79 AURKB (0.62) SRCLCKKDRJAK2FYN
SCHEMBL2960411 0.79 AURKB (0.62) SRCLCKKDRJAK2FYN
SCHEMBL2960409 0.79 AURKB (0.62) SRCLCKKDRJAK2FYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1973917-B1 PROTEIN KINASE INHIBITORS ABBVIE INC (US) 2015-06-10 — — EP disclosed
US-7772231-B2 Substituted pyrazolo[3,4-d]pyrimidines as protein kinase inhibitors ABBOTT LABORATORIES (US) 2010-08-10 — — US disclosed
US-20070203143-A1 PROTEIN KINASE INHIBITORS ABBVIE INC. 2007-08-30 — — 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-20070203143-A1 PROTEIN KINASE INHIBITORS PACSIN2, MAP3K20, PHKG1 SRC 106/4885LCK 111/4885KDR 1617/4885

“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.

Send feedback