SCHEMBL13635734

SCHEMBL13635734

Cc1c(C(=O)NC2CC2)ccc2[nH]nc(-c3cccc(F)c3)c12

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 5/20 0.52
MAP4K4 O95819 2/20 0.46
LRRK2 Q5S007 1/20 0.46
MAP3K5 Q99683 1/20 0.45
KDR P35968 1/20 0.43
HPGD P15428 1/20 0.43
GABRA5 P31644 2/20 0.43
MAP2K4 P45985 1/20 0.42
WNT1 P04628 1/20 0.42
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
MAPK8 P45983 1/20 0.41
CRHR1 P34998 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
SCHEMBL2866826 0.90 DYRK1A (0.52) DYRK1AMAP4K4LRRK2MAP3K5KDR
SCHEMBL2861298 0.87 DYRK1A (0.49) DYRK1AMAP4K4LRRK2MAP3K5KDR
SCHEMBL2861793 0.80 DYRK1A (0.53) DYRK1AMAP4K4LRRK2MAP3K5KDR
SCHEMBL2866807 0.79 DYRK1A (0.52) DYRK1AMAP4K4LRRK2MAP3K5KDR
SCHEMBL2862730 0.79 DYRK1A (0.59) DYRK1AMAP3K5
SCHEMBL2868590 0.78 DYRK1A (0.50) DYRK1AMAP4K4MAP2K4GSK3AGSK3B
SCHEMBL4149434 0.77 DYRK1A (0.52) DYRK1AMAP4K4MAP3K5MAP2K4WNT1
SCHEMBL2861587 0.76 KDR (0.49) DYRK1ALRRK2KDRWNT1GSK3B
SCHEMBL2872480 0.76 DYRK1A (0.56) DYRK1ALRRK2MAP3K5
SCHEMBL2872484 0.76 DYRK1A (0.56) DYRK1ALRRK2MAP3K5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1380576-B1 1H-INDAZOLE COMPOUNDS INHIBITING JNK EISAI R&D MAN CO LTD (JP) 2009-11-25 EP disclosed