SCHEMBL17313592

SCHEMBL17313592

CCN(CC)C(=O)c1cc2cc(CCc3cc(NC(=O)c4ccc(CN5CCN(C)CC5)c(C(F)(F)F)c4)ccc3C)cnc2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 10/20 0.56
▸ EGFR P00533 9/20 0.56
▸ ABL1 P00519 7/20 0.55
▸ FGFR1 P11362 1/20 0.54
▸ CYP2C9 P11712 1/20 0.54
▸ PDGFRA P16234 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ FLT3 P36888 1/20 0.54
▸ LRRK2 Q5S007 1/20 0.54
▸ HDAC6 Q9UBN7 1/20 0.54
▸ KIT P10721 2/20 0.54
▸ MAP3K7 O43318 1/20 0.52
▸ EPHA2 P29317 1/20 0.52
▸ CSK P41240 1/20 0.52
▸ MAP4K2 Q12851 1/20 0.52
▸ MAPK14 Q16539 1/20 0.52
▸ MAP3K20 Q9NYL2 1/20 0.52
▸ BCR P11274 1/20 0.52

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
SCHEMBL15859952 0.91 BRAF (0.59) BRAFEGFRABL1FGFR1CYP2C9
SCHEMBL15859992 0.91 BRAF (0.59) BRAFEGFRABL1FGFR1CYP2C9
SCHEMBL15859829 0.90 BRAF (0.57) BRAFEGFRABL1FGFR1CYP2C9
SCHEMBL15860000 0.90 BRAF (0.58) BRAFEGFRABL1FGFR1CYP2C9
SCHEMBL17324206 0.85 KIT (0.53) BRAFEGFRABL1FGFR1CYP2C9
SCHEMBL17324205 0.83 MAP3K20 (0.54) BRAFEGFRABL1FGFR1CYP2C9
SCHEMBL15860030 0.83 ABL1 (0.56) BRAFEGFRABL1FGFR1CYP2C9
SCHEMBL15859861 0.82 BRAF (0.60) BRAFEGFRABL1FGFR1CYP2C9
SCHEMBL31060809 0.82 BRAF (0.59) BRAFEGFRABL1FGFR1CYP2C9
SCHEMBL15859828 0.82 BRAF (0.59) BRAFEGFRABL1FGFR1CYP2C9

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
US-9550772-B2 Azaindole derivatives as multi kinase inhibitors ORIBASE PHARMA (FR) 2017-01-24 — — US disclosed
US-20150353539-A1 AZAINDOLE DERIVATIVES AS MULTI KINASE INHIBITORS ORIBASE PHARMA (FR) 2015-12-10 — — 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-20150353539-A1 AZAINDOLE DERIVATIVES AS MULTI KINASE INHIBITORS MAP2K2, MAP2K5, MAP2K3 BRAF 74/4885EGFR 1148/4885ABL1 68/4885

“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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