SCHEMBL22658562

SCHEMBL22658562

CN1C(=O)c2nc(C(F)(F)F)sc2N(C)c2nc(Cl)ncc21

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 18/20 0.46
▸ JUN P05412 2/20 0.39
▸ NFKB1 P19838 2/20 0.39
▸ NFKB2 Q00653 2/20 0.39
▸ RELA Q04206 2/20 0.39
▸ PLK1 P53350 1/20 0.32

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
SCHEMBL29517228 1.00 PTK2 (0.46) PTK2JUNNFKB1NFKB2RELA
SCHEMBL22658779 0.83 PTK2 (0.59) PTK2PLK1
SCHEMBL29517219 0.83 PTK2 (0.59) PTK2PLK1
SCHEMBL29517226 0.80 PTK2 (0.45) PTK2PLK1
SCHEMBL29517496 0.80 PTK2 (0.45) PTK2PLK1
SCHEMBL22658527 0.79 JUN (0.36) PTK2JUNNFKB1NFKB2RELA
SCHEMBL29517183 0.79 JUN (0.36) PTK2JUNNFKB1NFKB2RELA
SCHEMBL22658579 0.77 PTK2 (0.41) PTK2
SCHEMBL29517349 0.77 PTK2 (0.41) PTK2
SCHEMBL22658925 0.74 PTK2 (0.49) PTK2

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
EP-3965803-B1 SMALL-MOLECULE FOCAL ADHESION KINASE (FAK) INHIBITORS DANA FARBER CANCER INST INC (US) 2025-08-20 — — EP disclosed
US-12365696-B2 Small-molecule focal adhesion kinase (FAK) inhibitors DANA-FARBER CANCER INSTITUTE, INC. (US) 2025-07-22 — — US disclosed
US-20220242882-A1 SMALL-MOLECULE FOCAL ADHESION KINASE (FAK) INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-08-04 — — US disclosed
WO-2020231726-A1 SMALL-MOLECULE FOCAL ADHESION KINASE (FAK) INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-11-19 — — 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 (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-12365696-B2 Small-molecule focal adhesion kinase (FAK) inhibitors PTK2, CTTN, TNK2 PTK2 1/4885JUN 2669/4885NFKB1 1778/4885
US-20220242882-A1 SMALL-MOLECULE FOCAL ADHESION KINASE (FAK) INHIBITORS PTK2, CTTN, TNK2 PTK2 1/4885JUN 2669/4885NFKB1 1778/4885

“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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