SCHEMBL2928817

SCHEMBL2928817

CN(C)CCN(C(=O)C(F)(F)F)c1ccc(Cl)c(Nc2cncc(-c3ccc(O)cc3)n2)c1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.38
BRAF P15056 1/20 0.38
FGFR2 P21802 1/20 0.38
PIM1 P11309 12/20 0.37
FYN P06241 1/20 0.36
PIM3 Q86V86 11/20 0.35
PIM2 Q9P1W9 8/20 0.35

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
SCHEMBL2930097 0.92 BRAF (0.37) KDRBRAFFGFR2PIM1FYN
SCHEMBL2933652 0.88 BRAF (0.47) KDRBRAFPIM1FYNPIM3
SCHEMBL2933030 0.83 BRAF (0.46) KDRBRAFFYNPIM3PIM2
SCHEMBL2927174 0.80 BRAF (0.46) KDRBRAFPIM1FYNPIM3
Trifluoroacetic Acid SCHEMBL2928813 0.79 KDR (0.51) KDRFGFR2PIM1FYNPIM3
SCHEMBL13515288 0.77 KDR (0.56) KDRBRAFFGFR2PIM1FYN
Trifluoroacetic Acid SCHEMBL2930092 0.73 HDAC4 (0.44) KDRPIM3
SCHEMBL2928815 0.73 KDR (0.50) KDRFGFR2PIM1FYNPIM3
SCHEMBL2934386 0.72 BRAF (0.48) KDRBRAFPIM1FYNPIM3
SCHEMBL2934370 0.72 PIM3 (0.51) KDRBRAFFYNPIM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2044051-B1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB PUBL (SE) 2010-01-27 EP disclosed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 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 (1 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-20080039450-A1 Compounds NEK2, CSNK2A3, CSNK2A1 KDR 3834/4885BRAF 524/4885FGFR2 2868/4885

“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.