SCHEMBL12479546

SCHEMBL12479546

COC(=O)CC(Cc1ccccc1)c1nc(Nc2ccc(N3CCN(C(=O)O)CC3)cc2OC)ncc1C(F)(F)F

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 18/20 0.59
▸ MAPK3 P27361 1/20 0.53
▸ IGF1R P08069 1/20 0.53
▸ CDK2 P24941 1/20 0.53

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
SCHEMBL12479566 0.94 ALK (0.58) ALKMAPK3IGF1RCDK2
SCHEMBL14635793 0.93 ALK (0.65) ALK
SCHEMBL14576325 0.88 PTK2 (0.48) ALKCDK2
SCHEMBL12479604 0.88 ALK (0.58) ALKIGF1R
SCHEMBL14635756 0.87 ALK (0.64) ALK
SCHEMBL12479582 0.82 PTK2 (0.51) ALK
SCHEMBL12478599 0.82 PTK2 (0.50) ALK
SCHEMBL12479601 0.82 ALK (0.58) ALK
SCHEMBL14635977 0.81 ALK (0.56) ALK
SCHEMBL12478821 0.81 CCND3 (0.52) ALKCDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2675794-B1 SELECTIVE FAK INHIBITORS CANCER THERAPEUTICS CRC PTY LTD (AU) 2019-02-13 — — EP disclosed
US-9174946-B2 Selective FAK inhibitors CANCER THERAPEUTICS CRC PTY LTD (AU) 2015-11-03 — — US disclosed
US-9120761-B2 Selective FAK inhibitors CANCER THERAPEUTICS CRC PTY LTD (AU) 2015-09-01 — — US disclosed
EP-2675794-A1 SELECTIVE FAK INHIBITORS Cancer Therapeutics Crc Pty Limited (AU) 2013-12-25 — — EP disclosed
US-20130324546-A1 SELECTIVE FAK INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2013-12-05 — — US disclosed
US-20130022594-A1 SELECTIVE FAK INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2013-01-24 — — US disclosed
WO-2012110774-A1 SELECTIVE FAK INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2012-08-23 — — 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-20130324546-A1 SELECTIVE FAK INHIBITORS PTK2, CTTN, SRC ALK 406/4885MAPK3 237/4885IGF1R 245/4885
US-20130022594-A1 SELECTIVE FAK INHIBITORS PTK2, CTTN, SRC ALK 269/4885MAPK3 212/4885IGF1R 197/4885

“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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