SCHEMBL4909357

SCHEMBL4909357

Cc1ccc(NC(=O)c2ccc(CN(C)C)c(C(F)(F)F)c2)cc1Br

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.58
▸ HTT P42858 4/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ NPSR1 Q6W5P4 2/20 0.58
▸ MEN1 O00255 2/20 0.58
▸ NPC1 O15118 2/20 0.58
▸ RAB9A P51151 2/20 0.58
▸ XBP1 P17861 1/20 0.54
▸ BRAF P15056 5/20 0.52
▸ RAF1 P04049 2/20 0.52
▸ LMNA P02545 2/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ KIT P10721 2/20 0.51
▸ EGFR P00533 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ CLK1 P49759 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
SCHEMBL4903601 0.97 HTT (0.56) MAPTHTTKMT2ANPSR1MEN1
SCHEMBL4907378 0.88 MAPT (0.58) MAPTHTTKMT2ANPSR1MEN1
SCHEMBL23111995 0.86 KIT (0.67) MAPTHTTKMT2ANPSR1MEN1
SCHEMBL26429001 0.84 NPC1 (0.65) MAPTHTTKMT2ANPSR1MEN1
SCHEMBL4901580 0.81 KIT (0.64) HTTBRAFKITEGFRCLK1
SCHEMBL4903423 0.80 KIT (0.76) BRAFKITEGFR
SCHEMBL4910277 0.79 KIT (0.67) HTTBRAFKITEGFRCLK1
SCHEMBL4908467 0.79 KIT (0.61) HTTBRAFKITEGFR
SCHEMBL3932085 0.79 BRAF (0.73) BRAFKITEGFR
SCHEMBL4908759 0.79 KIT (0.66) HTTBRAFKITEGFRCLK1

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
CN-101696188-A Trifluoromethyl substituted benzamides as kinase inhibitors NOVARTIS AG 2010-04-21 — — CN disclosed
US-20080096883-A1 Trifluoromethyl substituted benzamides as kinase inhibitors NOVARTIS AG (CH) 2008-04-24 — — US disclosed
US-20080096883-A1 Trifluoromethyl substituted benzamides as kinase inhibitors NOVARTIS AG (CH) 2008-04-24 — — US disclosed
US-20080096883-A1 Trifluoromethyl substituted benzamides as kinase inhibitors NOVARTIS AG (CH) 2008-04-24 — — US disclosed
CN-101039914-A Trifluoromethyl substituted benzamide compounds as kinase inhibitors NOVARTIS AG (CH) 2007-09-19 — — CN disclosed
EP-1778640-A1 TRIFLUOROMETHYL SUBSTITUTED BENZAMIDES AS KINASE INHIBITORS Novartis AG (CH) 2007-05-02 — — EP disclosed
WO-2006015859-A1 TRIFLUOROMETHYL SUBSTITUTED BENZAMIDES AS KINASE INHIBITORS NOVARTIS AG (CH) 2006-02-16 — — WO disclosed
US-20060035897-A1 Trifluoromethyl substituted benzamides as kinase inhibitors NOVARTIS AG (CH) 2006-02-16 — — US 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 (2 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-20080096883-A1 Trifluoromethyl substituted benzamides as kinase inhibitors MAP3K1, MAP3K20, MAP3K2 MAPT 2516/4885HTT 3204/4885KMT2A 596/4885
US-20060035897-A1 Trifluoromethyl substituted benzamides as kinase inhibitors ABL1, ERBB2, EPHB2 MAPT 3074/4885HTT 4489/4885KMT2A 1608/4885

“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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