SCHEMBL15524693

SCHEMBL15524693

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

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 5/20 0.45
▸ GSK3A P49840 1/20 0.44
▸ GSK3B P49841 1/20 0.44
▸ PTK2 Q05397 11/20 0.44
▸ LCK P06239 2/20 0.41
▸ NTRK1 P04629 1/20 0.41
▸ CAMK2D Q13557 1/20 0.41
▸ KIT P10721 1/20 0.41
▸ FLT3 P36888 1/20 0.41

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
SCHEMBL15524522 0.91 CCNA2 (0.51) JAK3GSK3AGSK3BPTK2
SCHEMBL15524018 0.91 PTK2 (0.44) JAK3GSK3AGSK3BPTK2NTRK1
SCHEMBL12478740 0.90 PTK2 (0.53) PTK2
SCHEMBL12478690 0.90 PTK2 (0.53) JAK3GSK3AGSK3BPTK2
SCHEMBL12478260 0.87 PTK2 (0.54) PTK2
SCHEMBL15524830 0.86 PTK2 (0.49) PTK2
SCHEMBL12479026 0.84 PTK2 (0.51) PTK2
SCHEMBL15524349 0.84 FLT4 (0.52) PTK2KITFLT3
SCHEMBL12478056 0.84 PTK2 (0.53) PTK2
SCHEMBL15524715 0.83 CCNA2 (0.51) GSK3AGSK3BPTK2NTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9266864-B2 VEGFR3 inhibitors CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2016-02-23 — — US disclosed
US-20150225377-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2015-08-13 — — US disclosed
US-20140080798-A1 VEGFR3 INHIBITORS CANCER THERAPEUTICS CRC PTY LIMITED (AU) 2014-03-20 — — 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 (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-20150225377-A1 VEGFR3 INHIBITORS FLT4, FLT1, KDR JAK3 26/4885GSK3A 446/4885GSK3B 283/4885
US-20140080798-A1 VEGFR3 INHIBITORS FLT4, FLT1, KDR JAK3 26/4885GSK3A 419/4885GSK3B 294/4885

“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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