SCHEMBL2861577

SCHEMBL2861577

CC(C)(C)OC(=O)n1nc(-c2cccc(F)c2)c2cc(C(O)c3ccccc3)ccc21

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 1/20 0.53
PTGER1 P34995 3/20 0.39
PTGDR2 Q9Y5Y4 3/20 0.35
TACR3 P29371 7/20 0.35
HCRTR1 O43613 1/20 0.35
HCRTR2 O43614 1/20 0.35
KDM4E B2RXH2 1/20 0.35
IGFBP3 P17936 1/20 0.34
MAPT P10636 1/20 0.34
RORC P51449 1/20 0.33
TBXA2R P21731 1/20 0.33
PTGDR Q13258 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
SCHEMBL2868311 0.86 PTGER1 (0.44) PTGER1PTGDR2TACR3KDM4EIGFBP3
SCHEMBL2860870 0.82 MAP2K4 (0.61) MAP2K4PTGER1
SCHEMBL2871097 0.81 MAP2K4 (0.56) MAP2K4PTGER1MAPT
SCHEMBL2858091 0.81 MAP2K4 (0.56) MAP2K4PTGER1MAPT
SCHEMBL2862273 0.80 MAP2K4 (0.55) MAP2K4PTGER1KDM4EMAPT
SCHEMBL13198131 0.80 MAP2K4 (0.55) MAP2K4PTGER1MAPT
SCHEMBL2863260 0.80 MAP2K4 (0.58) MAP2K4PTGER1MAPT
SCHEMBL2864722 0.79 MAP2K4 (0.55) MAP2K4MAPT
SCHEMBL27538879 0.75 MAP2K4 (0.51) MAP2K4PTGER1MAPT
SCHEMBL25994433 0.75 MAP2K4 (0.56) MAP2K4PTGER1KDM4EMAPTRORC

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 10 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-7541376-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-02 US disclosed
CN-1300116-C 1H-indazole compounds EISAI CO LTD (JP) 2007-02-14 CN disclosed
US-6982274-B2 1H-indazole compound EISAI CO., LTD. (JP) 2006-01-03 US disclosed
US-20050282880-A1 Novel 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-12-22 US disclosed
CN-1512987-A Novel 1H-indazole compound ������������ʽ���� 2004-07-14 CN 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 (3 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 MAP2K4 61/4885PTGER1 3143/4885PTGDR2 1870/4885
US-20040127538-A1 Novel 1h-indazole compound MAPK1, MAPK14, MAPK3 MAP2K4 53/4885PTGER1 4240/4885PTGDR2 3758/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 MAP2K4 61/4885PTGER1 3143/4885PTGDR2 1870/4885

“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.