SCHEMBL2933161

SCHEMBL2933161

CCN(CC)CCN(C(=O)C(F)(F)F)c1ccc(Nc2cncc(-c3cc4cc(F)ccc4[nH]3)n2)c(Cl)c1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.33
CNR1 P21554 1/20 0.33
ALOX15 P16050 4/20 0.31
CCNA2 P20248 2/20 0.30
CDK2 P24941 2/20 0.30
TTK P33981 2/20 0.30
AURKA O14965 2/20 0.30

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
SCHEMBL2960852 0.90 BRAF (0.37) SYKCNR1CCNA2CDK2TTK
Trifluoroacetic Acid SCHEMBL2933159 0.83 MAPT (0.38) CNR1CCNA2CDK2
SCHEMBL2931629 0.82 MAPT (0.40) CNR1CCNA2CDK2
SCHEMBL2931067 0.81 BRAF (0.39) CCNA2CDK2TTKAURKA
SCHEMBL2928690 0.76 AURKA (0.47) SYKALOX15CCNA2CDK2TTK
SCHEMBL2930097 0.76 BRAF (0.37)
Trifluoroacetic Acid SCHEMBL2960848 0.74 TMEM97 (0.40) CCNA2CDK2
SCHEMBL2935070 0.73 BRAF (0.34) SYK
SCHEMBL2930653 0.73 TMEM97 (0.43) CCNA2CDK2TTK
SCHEMBL2928646 0.73 BRAF (0.37) SYKCCNA2CDK2TTKAURKA

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 SYK 1798/4885CNR1 1076/4885ALOX15 4048/4885

“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.