SCHEMBL4085361

SCHEMBL4085361

N#Cc1ccc(F)c(C(O)c2ccc(F)cc2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.40
TOP2B Q02880 1/20 0.40
EPHX2 P34913 1/20 0.38
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 0.37
MGLL Q99685 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
ALPG P10696 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP19A1 P11511 2/20 0.35
AR P10275 1/20 0.34
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
S1PR3 Q99500 2/20 0.33
SCN9A Q15858 3/20 0.33
PTGDR2 Q9Y5Y4 2/20 0.33
TNF P01375 1/20 0.33

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
SCHEMBL2861781 0.83 CES2 (0.38) TOP2ATOP2BMGLLCES2CES1
SCHEMBL4085392 0.81 CYP3A4 (0.42) TOP2ATOP2B
SCHEMBL1349663 0.81 KDM4E (0.48) TOP2ATOP2BEPHX2KDM4ETP53
SCHEMBL907710 0.79 EPHX2 (0.38) TOP2ATOP2BEPHX2KDM4ETP53
SCHEMBL4085359 0.79 EEF2K (0.40) TOP2ATOP2BMGLLALDH1A1SMN1; SMN2
SCHEMBL14255710 0.78 EPHX2 (0.40) TOP2ATOP2BEPHX2KDM4ETP53
SCHEMBL23882902 0.77 TOP2A (0.48) TOP2ATOP2BALDH1A1SMN1; SMN2CYP19A1
SCHEMBL30251256 0.77 TOP2A (0.48) TOP2ATOP2BALDH1A1SMN1; SMN2CYP19A1
SCHEMBL3949900 0.77 ABCB11 (0.42) LMNASMN1; SMN2CYP19A1
SCHEMBL7216331 0.76 GAA (0.41) MGLLALDH1A1SMN1; SMN2TNFSCN5A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2065383-A1 Indazole compounds and methods of use thereof as protein kinase inhibitors Signal Pharmaceuticals, Inc. (US) 2009-06-03 EP disclosed
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF BHAGWAT SHRIPAD S 2009-04-16 US disclosed
EP-1692128-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS Signal Pharmaceuticals LLC (US) 2006-08-23 EP disclosed
US-20060004043-A1 Indazole compounds and methods of use thereof BHAGWAT SHRIPAD S 2006-01-05 US disclosed
WO-2005051942-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2005-06-09 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 (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-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF WNT3, WNT3A, WNK3 TOP2A 3743/4885TOP2B 3769/4885EPHX2 3978/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 TOP2A 3830/4885TOP2B 3870/4885EPHX2 3831/4885

“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.