SCHEMBL2861298

SCHEMBL2861298

COc1c(C(=O)NC2CC2)ccc2[nH]nc(-c3cccc(F)c3)c12

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 3/20 0.49
LRRK2 Q5S007 1/20 0.46
CNR1 P21554 5/20 0.45
CNR2 P34972 5/20 0.45
MAP4K4 O95819 2/20 0.44
DRD3 P35462 1/20 0.43
NTRK1 P04629 2/20 0.43
KDR P35968 1/20 0.41
GABRA5 P31644 1/20 0.41
MAP3K5 Q99683 1/20 0.41
HPGD P15428 1/20 0.41
MAP2K4 P45985 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
SCHEMBL13635734 0.87 DYRK1A (0.52) DYRK1ALRRK2MAP4K4KDRGABRA5
SCHEMBL2866826 0.87 DYRK1A (0.52) DYRK1ALRRK2MAP4K4KDRMAP3K5
SCHEMBL2864594 0.85 KDR (0.47) DYRK1ALRRK2CNR1CNR2KDR
SCHEMBL4343211 0.84 MAP4K4 (0.45) DYRK1ALRRK2MAP4K4NTRK1MAP2K4
SCHEMBL2864633 0.84 MAP2K4 (0.47) LRRK2NTRK1MAP2K4
SCHEMBL2868590 0.82 DYRK1A (0.50) DYRK1AMAP4K4NTRK1MAP2K4
SCHEMBL4160452 0.81 DRD3 (0.44) DYRK1ACNR1CNR2DRD3NTRK1
SCHEMBL4160447 0.81 DRD3 (0.44) DYRK1ACNR1CNR2DRD3NTRK1
SCHEMBL4339874 0.80 NTRK1 (0.41) LRRK2NTRK1
SCHEMBL2864651 0.79 APEX1 (0.52) HPGD

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 11 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
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 DYRK1A 1216/4885LRRK2 282/4885CNR1 105/4885
US-20040127538-A1 Novel 1h-indazole compound MAPK1, MAPK14, MAPK3 DYRK1A 2459/4885LRRK2 817/4885CNR1 132/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 DYRK1A 1216/4885LRRK2 282/4885CNR1 105/4885

“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.