SCHEMBL2862067

SCHEMBL2862067

O=C(c1ccc2[nH]nc(-c3cccc(F)c3)c2c1)c1cccs1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TTK P33981 6/20 0.49
MAP2K4 P45985 4/20 0.46
MAPK1 P28482 5/20 0.42
MAPK6 Q16659 2/20 0.42
MAPKAPK3 Q16644 1/20 0.42
JAK3 P52333 1/20 0.41
NTRK1 P04629 1/20 0.41
DYRK1A Q13627 1/20 0.40
MAPK3 P27361 1/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL2868599 0.82 MAP2K4 (0.57) TTKMAP2K4MAPK1MAPK6MAPKAPK3
SCHEMBL2858476 0.81 MAP2K4 (0.68) TTKMAP2K4MAPK1MAPK6MAPKAPK3
SCHEMBL5801740 0.80 MAP2K4 (0.65) TTKMAP2K4MAPK1MAPK6MAPKAPK3
Ethylene SCHEMBL27536148 0.79 MAP2K4 (0.65) TTKMAP2K4MAPK1MAPK6MAPKAPK3
SCHEMBL2869817 0.78 MAP2K4 (0.54) TTKMAP2K4MAPK1MAPK6MAPKAPK3
SCHEMBL2860913 0.77 MAP2K4 (0.61) TTKMAP2K4MAPK1MAPK6MAPKAPK3
SCHEMBL2855642 0.76 CNR2 (0.41) JAK3MEN1MAPTKMT2A
SCHEMBL2862730 0.76 DYRK1A (0.59) DYRK1A
SCHEMBL2867237 0.74 MAP4K1 (0.52) MAPK1NTRK1DYRK1AMEN1MAPT
SCHEMBL5381114 0.74 TTK (0.67) TTKMAP2K4MEN1MAPTKMT2A

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 12 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
US-7776890-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-17 US disclosed
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-20090203691-A1 Novel 1H-indazole compounds OINUMA HITOSHI 2009-08-13 US 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
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
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 TTK 1201/4885MAP2K4 61/4885MAPK1 1/4885
US-20040127538-A1 Novel 1h-indazole compound MAPK1, MAPK14, MAPK3 TTK 1066/4885MAP2K4 53/4885MAPK1 1/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 TTK 1201/4885MAP2K4 61/4885MAPK1 1/4885

“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.