SCHEMBL1255932

SCHEMBL1255932

CC(C)(C)c1cc(NC(=O)Cc2ccc(-c3ccc(N)nc3)c(F)c2)no1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 9/20 0.52
▸ ROCK1 Q13464 1/20 0.49
▸ WNT3A P56704 2/20 0.47
▸ KIT P10721 2/20 0.46
▸ NTRK1 P04629 3/20 0.46
▸ FLT3 P36888 1/20 0.46
▸ EGFR P00533 1/20 0.46
▸ KDR P35968 2/20 0.45
▸ CSF1R P07333 1/20 0.45
▸ KCNH2 Q12809 1/20 0.45
▸ CCDC6 Q16204 1/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44

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
SCHEMBL1257901 0.96 RET (0.49) RETROCK1WNT3AKITNTRK1
SCHEMBL1254991 0.89 WNT3A (0.51) RETROCK1WNT3AKITNTRK1
SCHEMBL1256042 0.88 RET (0.62) RETROCK1KITNTRK1FLT3
SCHEMBL1256154 0.87 RET (0.55) RETROCK1KITNTRK1FLT3
SCHEMBL1255966 0.85 RET (0.54) RETROCK1WNT3AKITNTRK1
SCHEMBL1256868 0.84 EGFR (0.47) RETROCK1KITFLT3EGFR
SCHEMBL14674070 0.84 RET (0.51) RETROCK1KITNTRK1FLT3
SCHEMBL1256741 0.83 KIT (0.55) RETROCK1KITNTRK1FLT3
SCHEMBL1256852 0.83 EGFR (0.46) RETROCK1KITNTRK1FLT3
SCHEMBL14674327 0.82 RET (0.51) RETROCK1WNT3AKITNTRK1

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 9 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
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 RET 16/4885ROCK1 1225/4885WNT3A 1565/4885

“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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