SCHEMBL4339201

SCHEMBL4339201

CCOC(C(N)=O)n1nc(-c2cccc(F)c2)c2c(F)c(C(=O)O)ccc21

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.38
JAK3 P52333 1/20 0.38
DCLRE1B Q9H816 1/20 0.38
CSNK1D P48730 2/20 0.37
PTGER1 P34995 1/20 0.35
KDM4E B2RXH2 1/20 0.34
TRPM8 Q7Z2W7 2/20 0.34
CSNK1E P49674 2/20 0.34
DHODH Q02127 2/20 0.33
ICMT O60725 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
TACR3 P29371 2/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
EGFR P00533 1/20 0.33
DPP4 P27487 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
SCHEMBL4336462 0.83 CSNK1D (0.38) JAK2JAK3DCLRE1BCSNK1DPTGER1
SCHEMBL4341004 0.82 PTGER1 (0.36) DCLRE1BCSNK1DPTGER1CSNK1EDHODH
SCHEMBL4340947 0.82 PTGER1 (0.36) JAK2JAK3DCLRE1BCSNK1DPTGER1
SCHEMBL4334945 0.80 CSNK1E (0.38) JAK2JAK3DCLRE1BCSNK1DPTGER1
SCHEMBL4346820 0.77 PTGER1 (0.40) DCLRE1BCSNK1DPTGER1KDM4ECSNK1E
SCHEMBL4331950 0.76 CTSA (0.37) CSNK1DPTGER1CSNK1E
SCHEMBL4331815 0.76 JAK2 (0.37) JAK2JAK3KDM4EEGFR
SCHEMBL4341005 0.73 CSNK1E (0.34) DCLRE1BCSNK1DPTGER1CSNK1EEGFR
SCHEMBL4343214 0.72 CSNK1E (0.35) JAK2JAK3DCLRE1BCSNK1DPTGER1
SCHEMBL2865256 0.70 PTGER1 (0.41) DCLRE1BPTGER1KDM4ECSNK1EDHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7541376-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-02 US disclosed
US-20050282880-A1 Novel 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-12-22 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-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 JAK2 145/4885JAK3 776/4885DCLRE1B 4617/4885

“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.