SCHEMBL4060966

SCHEMBL4060966

Fc1ccccc1Oc1ccc2c(-c3ccccc3C(F)(F)F)n[nH]c2c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 1/20 0.41
TRPA1 O75762 10/20 0.40
SCN5A Q14524 2/20 0.38
SCN9A Q15858 2/20 0.38
ITK Q08881 2/20 0.37
AR P10275 2/20 0.37
PIM1 P11309 2/20 0.36
LRRK2 Q5S007 1/20 0.36
TRPM8 Q7Z2W7 2/20 0.36
TRPV1 Q8NER1 1/20 0.36
CHEK1 O14757 1/20 0.36
FGFR1 P11362 1/20 0.36
KDR P35968 1/20 0.36

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
SCHEMBL4063276 0.84 MAP4K1 (0.45) MAP2K4TRPA1ITKPIM1LRRK2
SCHEMBL4061642 0.84 MAP2K4 (0.43) MAP2K4TRPA1SCN5ASCN9AITK
SCHEMBL4068311 0.84 ITK (0.46) MAP2K4SCN9AITKCHEK1FGFR1
SCHEMBL4059673 0.82 MAP2K4 (0.62) MAP2K4TRPA1SCN5ASCN9AITK
SCHEMBL4058556 0.80 MAP2K4 (0.59) MAP2K4TRPA1SCN5ASCN9ALRRK2
SCHEMBL4061913 0.80 MAP2K4 (0.41) MAP2K4TRPA1ITKPIM1LRRK2
SCHEMBL4065232 0.79 MAP2K4 (0.48) MAP2K4TRPA1SCN5ASCN9AITK
SCHEMBL4060839 0.79 ITK (0.48) MAP2K4TRPA1ITKPIM1CHEK1
SCHEMBL4059001 0.78 MAP2K4 (0.40) MAP2K4TRPA1ITKPIM1LRRK2
SCHEMBL4057918 0.78 ITK (0.47) MAP2K4SCN9AITKPIM1CHEK1

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-7495015-B2 Indazole derivatives and methods for using the same ROCHE PALO ALTO LLC (US) 2009-02-24 US claimed
EP-1747202-A1 INDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM F.HOFFMANN-LA ROCHE AG (CH) 2007-01-31 EP claimed
US-20050215595-A1 Indazole derivatives and methods for using the same ROCHE PALO ALTO LLC 2005-09-29 US claimed
WO-2005085206-A1 INDAZOLE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM F. HOFFMANN-LA ROCHE AG (CH) 2005-09-15 WO claimed
US-7495015-B2 Indazole derivatives and methods for using the same ROCHE PALO ALTO LLC (US) 2009-02-24 US disclosed
US-7495015-B2 Indazole derivatives and methods for using the same ROCHE PALO ALTO LLC (US) 2009-02-24 US disclosed
US-7495015-B2 Indazole derivatives and methods for using the same ROCHE PALO ALTO LLC (US) 2009-02-24 US disclosed
US-20050215595-A1 Indazole derivatives and methods for using the same ROCHE PALO ALTO LLC 2005-09-29 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 (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-20050215595-A1 Indazole derivatives and methods for using the same MAPK1, MAP3K1, MAP3K7 MAP2K4 73/4885TRPA1 2970/4885SCN5A 2724/4885

“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.