SCHEMBL21391669

SCHEMBL21391669

COCCOc1cc2c(=O)c3c4ccc(C#N)cc4[nH]c3n(C(C)C)c2c(F)c1N1C[C@@H](C)N(C)[C@@H](C)C1

nearest known ligand 0.83

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 20/20 0.83
DAPK3 O43293 1/20 0.83
INSR P06213 1/20 0.83
INSRR P14616 1/20 0.83
LTK P29376 1/20 0.83
CLK1 P49759 1/20 0.83
DAPK1 P53355 1/20 0.83
MERTK Q12866 1/20 0.83
DAPK2 Q9UIK4 1/20 0.83

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
SCHEMBL23116623 1.00 ALK (0.83) ALKDAPK3INSRINSRRLTK
SCHEMBL29616752 0.91 ALK (1.00) ALKDAPK3INSRINSRRLTK
SCHEMBL20168588 0.91 ALK (1.00) ALKDAPK3INSRINSRRLTK
SCHEMBL21459035 0.91 ALK (1.00) ALKDAPK3INSRINSRRLTK
SCHEMBL21391668 0.89 ALK (0.87) ALKDAPK3INSRINSRRLTK
SCHEMBL23116612 0.89 ALK (0.87) ALKDAPK3INSRINSRRLTK
SCHEMBL20168624 0.86 ALK (0.90) ALKDAPK3INSRINSRRLTK
SCHEMBL20168664 0.86 ALK (0.90) ALKDAPK3INSRINSRRLTK
SCHEMBL20168720 0.86 ALK (0.90) ALKDAPK3INSRINSRRLTK
SCHEMBL21459161 0.85 ALK (0.86) ALKDAPK3INSRINSRRLTK

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-20210087188-A1 5,6-DIHYDRO-1 1H-INDOLO{2,3-B}QUINOLIN- 11-ONE COMPOUNDS AS ALK INHIBITORS The Regents oof the University of Michigan (US) 2021-03-25 US claimed
US-20210087188-A1 5,6-DIHYDRO-1 1H-INDOLO{2,3-B}QUINOLIN- 11-ONE COMPOUNDS AS ALK INHIBITORS The Regents oof the University of Michigan (US) 2021-03-25 US disclosed
US-20210087188-A1 5,6-DIHYDRO-1 1H-INDOLO{2,3-B}QUINOLIN- 11-ONE COMPOUNDS AS ALK INHIBITORS The Regents oof the University of Michigan (US) 2021-03-25 US disclosed
WO-2019179482-A1 5, 6-DIHYDRO-11H-INDOLO [2, 3-B] QUINOLIN-11-ONE COMPOUNDS AS ALK INHIBITORS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2019-09-26 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-20210087188-A1 5,6-DIHYDRO-1 1H-INDOLO{2,3-B}QUINOLIN- 11-ONE COMPOUNDS AS ALK INHIBITORS ALK, KRAS, ABL1 ALK 1/4885DAPK3 1440/4885INSR 51/4885

“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.