SCHEMBL31204146

SCHEMBL31204146

O=C(Nc1nc2ccc(Br)nn2n1)C1(F)CC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 8/20 0.39
▸ JAK1 P23458 7/20 0.39
▸ TYK2 P29597 5/20 0.39
▸ JAK3 P52333 4/20 0.39
▸ RIPK1 Q13546 1/20 0.33
▸ WNT1 P04628 2/20 0.33
▸ GSK3B P49841 2/20 0.33
▸ DYRK1A Q13627 2/20 0.33
▸ CLK2 P49760 1/20 0.33
▸ CLK3 P49761 1/20 0.33
▸ DGAT1 O75907 2/20 0.31
▸ ABL1 P00519 1/20 0.31
▸ OTUD7B Q6GQQ9 1/20 0.31
▸ USP30 Q70CQ3 1/20 0.31
▸ KHK P50053 1/20 0.30
▸ PIK3CG P48736 1/20 0.30

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
SCHEMBL31204072 0.92 JAK2 (0.34) JAK2JAK1TYK2JAK3DGAT1
SCHEMBL31204112 0.78 PIK3CG (0.41) JAK2JAK1TYK2JAK3RIPK1
SCHEMBL31204341 0.74 WNT3A (0.37) WNT1GSK3BDYRK1ACLK2CLK3
SCHEMBL31204259 0.68 MAP3K5 (0.53) WNT1GSK3BDYRK1ACLK2CLK3
SCHEMBL31204118 0.68 DYRK1A (0.33) WNT1GSK3BDYRK1ACLK2CLK3
SCHEMBL31204203 0.64 OTUD7B (0.47) WNT1GSK3BDYRK1AOTUD7BPIK3CG
SCHEMBL31204270 0.62 MAP3K5 (0.48) DYRK1AABL1OTUD7BPIK3CG
SCHEMBL30132037 0.60 NPC1 (0.36) —
SCHEMBL31204151 0.59 MAP3K5 (0.47) DYRK1AABL1OTUD7BPIK3CG
SCHEMBL31204048 0.57 DAGLA (0.37) DYRK1AABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4727938-A1 BICYCLIC HETEROAROMATIC COMPOUNDS FOR TREATING NEUROLOGICAL DISORDERS Prothena Biosciences Limited (IE) 2026-04-22 — — EP disclosed
WO-2024259121-A1 BICYCLIC HETEROAROMATIC COMPOUNDS FOR TREATING NEUROLOGICAL DISORDERS PROTHENA BIOSCIENCES LIMITED (IE) 2024-12-19 — — WO disclosed
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