SCHEMBL14576997

SCHEMBL14576997

CNC(=O)CC(Cc1ccccc1)c1nc(Nc2ccc(N3CCN(C(=O)O)CC3)cc2)ncc1C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 10/20 0.51
▸ CDK4 P11802 1/20 0.45
▸ CCND1 P24385 1/20 0.45
▸ EGFR P00533 2/20 0.45
▸ SYK P43405 2/20 0.45
▸ FGFR1 P11362 4/20 0.44
▸ JAK2 O60674 1/20 0.43

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
SCHEMBL14576325 0.91 PTK2 (0.48) PTK2CDK4CCND1EGFRSYK
SCHEMBL12478740 0.91 PTK2 (0.53) PTK2CDK4CCND1EGFRSYK
SCHEMBL12478821 0.83 CCND3 (0.52) PTK2CDK4CCND1EGFRSYK
SCHEMBL15524018 0.81 PTK2 (0.44) PTK2JAK2
SCHEMBL15524693 0.81 JAK3 (0.45) PTK2
SCHEMBL12478240 0.81 PTK2 (0.48) PTK2SYKJAK2
SCHEMBL12478690 0.80 PTK2 (0.53) PTK2SYK
SCHEMBL15524121 0.80 SYK (0.51) CDK4CCND1SYK
SCHEMBL12479546 0.79 ALK (0.59) —
SCHEMBL15524290 0.79 SYK (0.47) CDK4CCND1SYKJAK2

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-2675793-B1 FAK INHIBITORS CANCER THERAPEUTICS CRC PTY LTD (AU) 2018-08-08 — — EP disclosed
US-9421205-B2 FAK inhibitors Cancer Therapeutics CRC Pty Ltd. (AU) 2016-08-23 — — US disclosed
US-20150231135-A1 FAK INHIBITORS Cancer Therapeutics CRC Pty Ltd. (AU) 2015-08-20 — — US disclosed
US-9012461-B2 FAK inhibitors CANCER THERAPEUTICS CRC PTY LTD (AU) 2015-04-21 — — US disclosed
WO-2014027199-A1 FAK AND FLT3 INHIBITORS CANCER THERAPEUTICS CRC PTY LTD (AU) 2014-02-20 — — WO disclosed
US-20130324532-A1 FAK INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2013-12-05 — — US disclosed
US-20130017194-A1 FAK INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2013-01-17 — — US 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 (3 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-20130017194-A1 FAK INHIBITORS PTK2, CTTN, SRC PTK2 1/4885CDK4 387/4885CCND1 486/4885
US-20130324532-A1 FAK INHIBITORS PTK2, CTTN, SRC PTK2 1/4885CDK4 387/4885CCND1 486/4885
US-20150231135-A1 FAK INHIBITORS PTK2, CTTN, SRC PTK2 1/4885CDK4 473/4885CCND1 603/4885

“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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