SCHEMBL15524585

SCHEMBL15524585

CC(C)(C)OC(=O)NCc1ccc(Nc2ncc(C(F)(F)F)c(C(CC(N)=O)Cc3ccccc3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 6/20 0.45
▸ CNR2 P34972 5/20 0.45
▸ FLT4 P35916 1/20 0.43
▸ IGF1R P08069 1/20 0.42
▸ BTK Q06187 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C8 P10632 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ NPR3 P17342 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ BRD4 O60885 1/20 0.40
▸ GSK3A P49840 1/20 0.40
▸ GSK3B P49841 1/20 0.40

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
SCHEMBL15524415 0.90 CNR2 (0.48) PTK2CNR2BTKGSK3AGSK3B
SCHEMBL15524302 0.89 IGF1R (0.44) CNR2IGF1RBTKKDM4EMAPT
SCHEMBL15524532 0.83 FLT4 (0.39) PTK2FLT4MAPTCYP3A4CYP2C8
SCHEMBL15524522 0.82 CCNA2 (0.51) PTK2FLT4GSK3AGSK3B
SCHEMBL15524110 0.82 PTK2 (0.46) PTK2FLT4
SCHEMBL15524495 0.81 FLT4 (0.48) PTK2CNR2FLT4GSK3AGSK3B
SCHEMBL14577154 0.81 PTK2 (0.52) PTK2FLT4
SCHEMBL15524665 0.80 GSK3A (0.40) PTK2CNR2MAPTGSK3AGSK3B
SCHEMBL14576729 0.79 PTK2 (0.49) PTK2FLT4
SCHEMBL15524831 0.79 EGFR (0.46) CNR2BTK

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
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
US-20090068168-A1 SUBSTITUTED AMINO ALCOHOLS AUSPEX PHARMACEUTICALS, INC. (US) 2009-03-12 — — 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-20090068168-A1 SUBSTITUTED AMINO ALCOHOLS GOT1, AADAT, ADH1A PTK2 3451/4885CNR2 3404/4885FLT4 4643/4885
US-20150225377-A1 VEGFR3 INHIBITORS FLT4, FLT1, KDR PTK2 240/4885CNR2 1834/4885FLT4 1/4885
US-20140080798-A1 VEGFR3 INHIBITORS FLT4, FLT1, KDR PTK2 260/4885CNR2 1810/4885FLT4 1/4885

“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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