SCHEMBL1256030

SCHEMBL1256030

COc1cc(-c2ccc(N)nc2)ccc1NC(=O)Nc1cc(C(C)(C)C)on1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.53
▸ NPC1 O15118 3/20 0.53
▸ POLB P06746 2/20 0.51
▸ MAPT P10636 3/20 0.50
▸ HTT P42858 3/20 0.50
▸ FLT3 P36888 2/20 0.50
▸ ATM Q13315 1/20 0.50
▸ KDR P35968 2/20 0.49
▸ RAF1 P04049 3/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ BRAF P15056 4/20 0.47
▸ MAPK14 Q16539 1/20 0.47

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
SCHEMBL1257742 0.96 RAB9A (0.49) RAB9ANPC1POLBMAPTHTT
SCHEMBL1254981 0.91 RAB9A (0.53) RAB9ANPC1POLBMAPTHTT
SCHEMBL1257098 0.90 BRAF (0.47) RAB9ANPC1POLBMAPTHTT
SCHEMBL1257945 0.87 BRAF (0.45) RAB9ANPC1POLBMAPTHTT
SCHEMBL1256020 0.86 MAPT (0.66) RAB9ANPC1POLBMAPTHTT
SCHEMBL1257303 0.86 RAB9A (0.69) RAB9ANPC1POLBMAPTHTT
SCHEMBL1257220 0.84 KDR (0.57) RAB9ANPC1MAPTHTTFLT3
SCHEMBL1698775 0.83 MAPT (0.61) RAB9ANPC1POLBMAPTHTT
SCHEMBL1255958 0.82 KDR (0.67) RAB9ANPC1FLT3KDRRAF1
SCHEMBL14164118 0.81 MEN1 (0.61) RAB9ANPC1FLT3KDRRAF1

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 RAB9A 1902/4885NPC1 1964/4885POLB 1861/4885

“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.

Send feedback