SCHEMBL31204203

SCHEMBL31204203

O=C(Nc1nc2ccc(-c3ccc4ncccc4c3)cn2n1)C1(F)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ OTUD7B Q6GQQ9 1/20 0.47
▸ PIK3CG P48736 12/20 0.46
▸ PIK3CA P42336 6/20 0.46
▸ PIK3CD O00329 6/20 0.43
▸ PIK3CB P42338 1/20 0.43
▸ GSK3B P49841 1/20 0.43
▸ TTK P33981 2/20 0.42
▸ NPC1 O15118 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ CLK1 P49759 2/20 0.41
▸ WNT1 P04628 1/20 0.41
▸ DYRK1A Q13627 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
SCHEMBL31204112 0.74 PIK3CG (0.41) PIK3CGPIK3CAPIK3CDPIK3CB
SCHEMBL3087482 0.71 PIK3CG (0.63) PIK3CGPIK3CAPIK3CDPIK3CB
SCHEMBL13031379 0.66 JAK1 (0.67) GSK3B
SCHEMBL3093859 0.65 PIK3CG (0.72) PIK3CGPIK3CAPIK3CDPIK3CB
SCHEMBL3081270 0.64 PIK3CG (0.68) PIK3CGPIK3CAPIK3CDPIK3CB
SCHEMBL29757180 0.64 NPC1 (1.00) PIK3CAPIK3CDGSK3BNPC1POLB
SCHEMBL30743 0.64 NPC1 (1.00) PIK3CAPIK3CDGSK3BNPC1POLB
SCHEMBL31204329 0.64 GSK3B (0.52) GSK3BWNT1DYRK1A
SCHEMBL31204341 0.64 WNT3A (0.37) GSK3BWNT1DYRK1A
SCHEMBL19031312 0.64 OTUD7B (1.00) OTUD7BNPC1POLB

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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