SCHEMBL16769797

SCHEMBL16769797

Cc1ncc(COc2cc(F)cc(Oc3ccc(-c4cn([C@H]5C[C@@](C)(O)C5)c5ncnc(N)c45)cc3)c2)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LCK P06239 11/20 0.48
▸ SRC P12931 11/20 0.48
▸ TEK Q02763 9/20 0.48
▸ KDR P35968 6/20 0.48
▸ BTK Q06187 4/20 0.48
▸ FLT3 P36888 4/20 0.48
▸ FYN P06241 3/20 0.48
▸ RET P07949 2/20 0.48
▸ FLT1 P17948 2/20 0.48
▸ NTRK3 Q16288 2/20 0.48
▸ NTRK2 Q16620 2/20 0.48
▸ AURKB Q96GD4 2/20 0.48
▸ PDGFRB P09619 1/20 0.48
▸ PDGFRA P16234 1/20 0.48
▸ LTK P29376 1/20 0.48
▸ MAP2K2 P36507 1/20 0.48
▸ CDK8 P49336 1/20 0.48
▸ MAP2K1 Q02750 1/20 0.48
▸ ACVR1 Q04771 1/20 0.48
▸ TNK2 Q07912 1/20 0.48

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
SCHEMBL16769691 0.89 SRC (0.56) LCKSRCTEKKDRBTK
SCHEMBL16769962 0.87 LCK (0.63) LCKSRCTEKKDRBTK
SCHEMBL16769946 0.85 LCK (0.51) LCKSRCTEKKDRBTK
SCHEMBL16769981 0.85 SRC (0.58) LCKSRCTEKKDRBTK
SCHEMBL16769800 0.85 SRC (0.58) LCKSRCTEKKDRBTK
SCHEMBL16769918 0.83 BTK (0.52) LCKSRCTEKKDRBTK
SCHEMBL16769986 0.81 KDR (0.62) LCKSRCTEKKDRBTK
SCHEMBL16769958 0.81 TEK (0.54) LCKSRCTEKKDRBTK
SCHEMBL18925747 0.81 SRC (0.60) LCKSRCTEKKDRBTK
SCHEMBL16769686 0.80 LCK (0.61) LCKSRCTEKKDRBTK

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
US-20170158697-A1 Protein Kinase Inhibitors PHARMASCIENCE INC. (CA) 2017-06-08 — — US disclosed
US-20170158697-A1 Protein Kinase Inhibitors PHARMASCIENCE INC. (CA) 2017-06-08 — — US disclosed
WO-2015077866-A1 PROTEIN KINASE INHIBITORS PHARMASCIENCE INC. (CA) 2015-06-04 — — WO 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-20170158697-A1 Protein Kinase Inhibitors TEC, LCK, SRC LCK 2/4885SRC 3/4885TEK 1662/4885

“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.

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