SCHEMBL1257303

SCHEMBL1257303

CC(C)(C)c1cc(NC(=O)Nc2ccc(-c3ccc(N)nc3)cc2F)no1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 2/20 0.69
▸ NPC1 O15118 1/20 0.69
▸ FLT3 P36888 9/20 0.63
▸ MAPK14 Q16539 4/20 0.55
▸ MAPK13 O15264 1/20 0.55
▸ MAPT P10636 3/20 0.52
▸ HTT P42858 3/20 0.52
▸ ATM Q13315 1/20 0.52
▸ KDR P35968 3/20 0.51
▸ KDM4E B2RXH2 1/20 0.50
▸ POLB P06746 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50

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
SCHEMBL1256894 0.89 RAB9A (0.62) RAB9ANPC1FLT3MAPK14MAPK13
SCHEMBL1256020 0.88 MAPT (0.66) RAB9ANPC1FLT3MAPK14MAPT
SCHEMBL1256030 0.86 RAB9A (0.53) RAB9ANPC1FLT3MAPK14MAPT
SCHEMBL1257220 0.86 KDR (0.57) RAB9ANPC1FLT3MAPK14MAPK13
SCHEMBL1255958 0.84 KDR (0.67) RAB9ANPC1FLT3MAPK14MAPK13
SCHEMBL1257348 0.83 MAPK14 (0.59) RAB9ANPC1FLT3MAPK14KDR
SCHEMBL1257742 0.83 RAB9A (0.49) RAB9ANPC1FLT3MAPK14MAPT
SCHEMBL14164118 0.82 MEN1 (0.61) RAB9ANPC1FLT3MAPK14MAPK13
SCHEMBL13234413 0.82 RAB9A (1.00) RAB9ANPC1FLT3MAPK14MAPK13
SCHEMBL1256741 0.82 KIT (0.55) RAB9ANPC1FLT3MAPK14KDR

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 1964/4885FLT3 1/4885

“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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