SCHEMBL1256284

SCHEMBL1256284

CC(C)(C)c1cc(NC(=O)Cc2ccc(-c3cnc(NCCN4CCOCC4)nc3)cc2)no1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.56
RET P07949 6/20 0.53
BRAF P15056 5/20 0.51
NTRK1 P04629 2/20 0.49
KIT P10721 2/20 0.49
SLC2A1 P11166 1/20 0.49
FLT3 P36888 3/20 0.48
ROCK1 Q13464 1/20 0.47
KDR P35968 3/20 0.46
CSF1R P07333 2/20 0.46
KCNH2 Q12809 1/20 0.46
CCDC6 Q16204 1/20 0.46
PDGFRB P09619 1/20 0.45
DDR1 Q08345 1/20 0.45

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
SCHEMBL1256158 0.92 EGFR (0.56) EGFRRETBRAFNTRK1KIT
SCHEMBL14673966 0.89 EGFR (0.52) EGFRRETBRAFNTRK1KIT
SCHEMBL1256177 0.87 SLC2A1 (0.62) RETKITSLC2A1FLT3KDR
SCHEMBL1257507 0.86 FLT3 (0.57) EGFRRETBRAFKITSLC2A1
SCHEMBL14680022 0.84 EGFR (0.55) EGFRRETNTRK1KITFLT3
SCHEMBL1257127 0.84 KIT (0.48) EGFRRETBRAFNTRK1KIT
SCHEMBL14681237 0.82 RET (0.61) EGFRRETBRAFKITSLC2A1
SCHEMBL1256817 0.82 RET (0.51) EGFRRETNTRK1KITFLT3
SCHEMBL1255252 0.81 KIT (0.46) EGFRRETBRAFNTRK1KIT
SCHEMBL13200082 0.81 EGFR (0.61) EGFRRETKITFLT3KDR

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130035326-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2013-02-07 US claimed
EP-2467137-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF Ambit Biosciences Corporation (US) 2012-06-27 EP claimed
WO-2011022473-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2011-02-24 WO claimed
US-20130035326-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2013-02-07 US disclosed
US-20130035326-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2013-02-07 US disclosed
EP-2467137-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF Ambit Biosciences Corporation (US) 2012-06-27 EP disclosed
WO-2011022473-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2011-02-24 WO disclosed
WO-2011022473-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2011-02-24 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-20130035326-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF FLT3, CSF3R, CSF1R EGFR 252/4885RET 16/4885BRAF 75/4885

“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.