SCHEMBL2865663

SCHEMBL2865663

O=C(NC1CC1)c1cc(F)c2[nH]nc(-c3cccc(F)c3)c2c1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.48
MAP4K4 O95819 2/20 0.46
GABRA5 P31644 2/20 0.44
GRM5 P41594 1/20 0.44
MAP2K4 P45985 2/20 0.43
MAPK8 P45983 1/20 0.43
MAP3K5 Q99683 1/20 0.42
HPGDS O60760 2/20 0.42
LRRK2 Q5S007 1/20 0.42
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
AR P10275 1/20 0.41

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
SCHEMBL2860005 0.90 DYRK1A (0.48) DYRK1AMAP4K4GABRA5GRM5MAP2K4
SCHEMBL2870015 0.87 DYRK1A (0.46) DYRK1AGABRA5
SCHEMBL2870995 0.85 MCHR1 (0.47) MAPK8
SCHEMBL4339193 0.84 APOL1 (0.42) DYRK1AMAP2K4
SCHEMBL2866665 0.84 GABRA5 (0.48) GABRA5GSK3BAR
SCHEMBL2862730 0.83 DYRK1A (0.59) DYRK1AMAP3K5
SCHEMBL2861586 0.81 MAP2K4 (0.56) MAP2K4
SCHEMBL13927826 0.81 ATM (0.41) DYRK1AMAP4K4GRM5AR
SCHEMBL2861793 0.80 DYRK1A (0.53) DYRK1AMAP4K4MAP2K4MAPK8MAP3K5
SCHEMBL2872480 0.80 DYRK1A (0.56) DYRK1AMAP3K5LRRK2

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 8 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
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 DYRK1A 1216/4885MAP4K4 63/4885GABRA5 3422/4885
US-20040127538-A1 Novel 1h-indazole compound MAPK1, MAPK14, MAPK3 DYRK1A 2459/4885MAP4K4 63/4885GABRA5 2856/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 DYRK1A 1216/4885MAP4K4 63/4885GABRA5 3422/4885

“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.