SCHEMBL2863452

SCHEMBL2863452

COc1[c]ccc2c1c(-c1cccc(F)c1)nn2C(N)=O

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.37
CSNK1E P49674 6/20 0.36
PDE10A Q9Y233 1/20 0.36
HPGDS O60760 1/20 0.36
RIPK2 O43353 1/20 0.35
PDE4B Q07343 1/20 0.35
CSNK1D P48730 5/20 0.35
F2RL3 Q96RI0 1/20 0.34
TRPA1 O75762 1/20 0.34
JAK2 O60674 1/20 0.34
JAK3 P52333 1/20 0.34
MAP2K4 P45985 1/20 0.34
FYN P06241 2/20 0.34
RORC P51449 1/20 0.34

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
SCHEMBL2868314 0.85 HPGDS (0.36) CSNK1EHPGDSCSNK1DFYN
SCHEMBL2868714 0.84 HPGDS (0.35) CSNK1EHPGDSPDE4BCSNK1DFYN
SCHEMBL2871125 0.83 SRC (0.43) PDE10ARIPK2JAK2JAK3
SCHEMBL2864915 0.77 TRPA1 (0.36) PTGDR2CSNK1ERIPK2PDE4BCSNK1D
SCHEMBL4149445 0.74 HPGDS (0.36) CSNK1EHPGDSPDE4BCSNK1DJAK3
SCHEMBL2866229 0.74 PIK3CD (0.40) JAK2JAK3FYN
SCHEMBL2863047 0.72 PTGER1 (0.39) CSNK1EHPGDSCSNK1DJAK3MAP2K4
SCHEMBL2863191 0.70 SRC (0.42) RIPK2
SCHEMBL16720416 0.68 PDGFRB (0.42) PTGDR2PDE4BFYN
SCHEMBL2861119 0.66 PDE4B (0.36) CSNK1EHPGDSRIPK2PDE4BCSNK1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7776890-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-17 US disclosed
EP-1380576-B1 1H-INDAZOLE COMPOUNDS INHIBITING JNK EISAI R&D MAN CO LTD (JP) 2009-11-25 EP disclosed
US-20090203691-A1 Novel 1H-indazole compounds OINUMA HITOSHI 2009-08-13 US disclosed
US-6982274-B2 1H-indazole compound EISAI CO., LTD. (JP) 2006-01-03 US disclosed
US-20040127538-A1 Novel 1h-indazole compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-07-01 US disclosed
EP-1380576-A1 NOVEL 1H-INDAZOLE COMPOUND Eisai Co., Ltd. (JP) 2004-01-14 EP 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-20090203691-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 PTGDR2 1870/4885CSNK1E 202/4885PDE10A 2782/4885
US-20040127538-A1 Novel 1h-indazole compound MAPK1, MAPK14, MAPK3 PTGDR2 3758/4885CSNK1E 130/4885PDE10A 3478/4885

“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.