SCHEMBL2933890

SCHEMBL2933890

COc1cc(Nc2cncc(-c3ccc(O)cc3)n2)c(Cl)cc1C(=O)N(C)CCCN(C)C

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRAF P15056 9/20 0.47
LRRK2 Q5S007 4/20 0.47
PIM3 Q86V86 2/20 0.43
RAF1 P04049 1/20 0.40
FYN P06241 1/20 0.39
KDR P35968 2/20 0.38
PIM1 P11309 1/20 0.36
PIM2 Q9P1W9 1/20 0.36

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
SCHEMBL2934386 0.95 BRAF (0.48) BRAFLRRK2PIM3RAF1FYN
SCHEMBL2930611 0.88 FYN (0.50) BRAFLRRK2PIM3RAF1FYN
SCHEMBL2933758 0.86 KDR (0.49) BRAFLRRK2PIM3RAF1FYN
SCHEMBL2933849 0.83 BRAF (0.56) BRAFLRRK2PIM3RAF1
SCHEMBL2927734 0.81 LRRK2 (0.44) BRAFLRRK2PIM3
SCHEMBL2934249 0.80 BRAF (0.45) BRAFLRRK2PIM3RAF1KDR
SCHEMBL2933495 0.79 ADRA2A (0.52) BRAFLRRK2PIM3
SCHEMBL2933983 0.78 BRAF (0.48) BRAFLRRK2PIM3RAF1
SCHEMBL2934782 0.78 BRAF (0.43) BRAFLRRK2PIM3RAF1
SCHEMBL2931521 0.76 BRAF (0.42) BRAFLRRK2PIM3RAF1

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 6 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
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
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 US disclosed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 US disclosed
WO-2007147874-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB (PUBL) (SE) 2007-12-27 WO 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 BRAF 524/4885LRRK2 309/4885PIM3 2131/4885

“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.