SCHEMBL22658808

SCHEMBL22658808

CN1CCN(c2ccc(Nc3ncc4c(n3)N(C)c3sc(-c5ccccc5)nc3C(=O)N4C)cc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 12/20 0.62
▸ DCLK1 O15075 1/20 0.53
▸ LRRK2 Q5S007 1/20 0.53
▸ TNK2 Q07912 1/20 0.51
▸ CDK4 P11802 1/20 0.51
▸ CCND1 P24385 1/20 0.51
▸ CCND2 P30279 1/20 0.51
▸ CCND3 P30281 1/20 0.51
▸ PLK1 P53350 1/20 0.51
▸ MAPK7 Q13164 1/20 0.50
▸ MAP4K1 Q92918 1/20 0.50
▸ JAK3 P52333 1/20 0.50
▸ EGFR P00533 1/20 0.49
▸ ALK Q9UM73 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
SCHEMBL29517467 0.80 PTK2 (0.81) PTK2DCLK1LRRK2TNK2PLK1
SCHEMBL22658662 0.80 PTK2 (0.81) PTK2DCLK1LRRK2TNK2PLK1
SCHEMBL16065698 0.79 LRRK2 (0.63) DCLK1LRRK2TNK2MAPK7MAP4K1
SCHEMBL10098748 0.79 LRRK2 (0.79) DCLK1LRRK2TNK2MAPK7
SCHEMBL10098757 0.77 TNK2 (0.71) DCLK1LRRK2TNK2CDK4CCND1
SCHEMBL20628296 0.77 STK3 (0.71) PTK2DCLK1LRRK2TNK2CDK4
SCHEMBL28676729 0.77 PTK2 (1.00) PTK2PLK1
SCHEMBL22658579 0.75 PTK2 (0.41) PTK2
SCHEMBL29517349 0.75 PTK2 (0.41) PTK2
SCHEMBL16065699 0.73 LRRK2 (0.57) DCLK1LRRK2TNK2MAPK7

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 6 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
CN-113811324-B Small molecule local Focal Adhesion Kinase (FAK) inhibitors 达纳-法伯癌症研究公司 2024-09-24 — — CN disclosed
US-20220242882-A1 SMALL-MOLECULE FOCAL ADHESION KINASE (FAK) INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-08-04 — — US disclosed
EP-3965803-A1 SMALL-MOLECULE FOCAL ADHESION KINASE (FAK) INHIBITORS Dana-Farber Cancer Institute, Inc. (US) 2022-03-16 — — EP 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 1/4885DCLK1 721/4885LRRK2 908/4885
US-20220242882-A1 SMALL-MOLECULE FOCAL ADHESION KINASE (FAK) INHIBITORS PTK2, CTTN, TNK2 PTK2 1/4885DCLK1 721/4885LRRK2 908/4885

“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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