SCHEMBL1773124

SCHEMBL1773124

Cc1[nH]c2ncc(N)cc2c1C

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.36
ABL1 P00519 5/20 0.35
ABL2 P42684 5/20 0.35
PRKCA P17252 1/20 0.35
MAP4K1 Q92918 3/20 0.33
PARP1 P09874 1/20 0.33
AHR P35869 1/20 0.31

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
SCHEMBL13199577 0.80 PDK2 (0.43)
SCHEMBL1565081 0.77 CHEK1 (0.45) EGFRABL1ABL2
SCHEMBL13940648 0.77 AHR (0.31) EGFRAHR
SCHEMBL8326471 0.74 KDM4E (0.33)
SCHEMBL25302317 0.73 PDK2 (0.30)
SCHEMBL8326499 0.73 EGFR (0.43) EGFRABL1
SCHEMBL8325679 0.73 EGFR (0.40) EGFRMAP4K1
SCHEMBL8802419 0.72 EGFR (0.37) EGFRABL1ABL2PRKCAAHR
SCHEMBL21417191 0.71 MAP4K1 (0.46) ABL1MAP4K1
SCHEMBL1773186 0.70 IDO1 (0.41)

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-8338452-B2 Raf inhibitor compounds and methods of use thereof ARRAY BIOPHARMA INC. (US) 2012-12-25 US disclosed
US-20110110889-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF Array Bio Pharma Inc. (US) 2011-05-12 US disclosed
EP-2265608-A2 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2010-12-29 EP disclosed
WO-2009111278-A2 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2009-09-11 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-20110110889-A1 RAF INHIBITOR COMPOUNDS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF EGFR 540/4885ABL1 210/4885ABL2 500/4885

“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.