SCHEMBL5848416

SCHEMBL5848416

O=C(c1nc(-c2ccncc2)c(-c2ccc(Cl)c(O)c2)[nH]1)N1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRAF P15056 11/20 0.49
RAF1 P04049 1/20 0.48
CNR1 P21554 2/20 0.47
HPGD P15428 2/20 0.41
HSP90AA1 P07900 1/20 0.41
ALDH1A1 P00352 2/20 0.40
PDE10A Q9Y233 1/20 0.40
CYP2C9 P11712 1/20 0.40
KDM4E B2RXH2 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL5850203 0.93 CNR1 (0.47) BRAFRAF1CNR1HPGDALDH1A1
SCHEMBL12856511 0.88 RAF1 (0.51) BRAFRAF1CNR1HPGDALDH1A1
SCHEMBL5850170 0.82 BRAF (0.56) BRAFRAF1
SCHEMBL5848384 0.82 BRAF (0.59) BRAFRAF1
SCHEMBL6580921 0.76 BRAF (0.67) BRAFRAF1
SCHEMBL5848398 0.73 MAPK13 (0.53) BRAFRAF1HPGDALDH1A1KDM4E
SCHEMBL2029325 0.73 MAPK14 (0.56) BRAFRAF1HPGDALDH1A1KDM4E
SCHEMBL8603189 0.71 MAPK13 (0.50) BRAFRAF1HPGDALDH1A1KDM4E
SCHEMBL12856388 0.70 BRAF (0.90) BRAFRAF1
SCHEMBL6175640 0.69 BRAF (0.43) BRAFCYP2C9KDM4E

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-6987119-B2 Imidazol-2-carboxamide derivatives as raf kinase inhibitors SMITHKLINE BEECHAM P.L.C. (GB) 2006-01-17 US claimed
US-6987119-B2 Imidazol-2-carboxamide derivatives as raf kinase inhibitors SMITHKLINE BEECHAM P.L.C. (GB) 2006-01-17 US disclosed
EP-1261602-B1 IMIDAZOL-2-CARBOXAMIDE DERIVATIVES AS RAF KINASE INHIBITORS SMITHKLINE BEECHAM PLC (GB) 2004-05-06 EP disclosed
US-20030134837-A1 Imidazol-2-carboxamide derivatives as raf kinase inhibitors GAIBA ALESSANDRA (GB) 2003-07-17 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-20030134837-A1 Imidazol-2-carboxamide derivatives as raf kinase inhibitors BRAF, RAF1, ARAF BRAF 1/4885RAF1 2/4885CNR1 368/4885

“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.