SCHEMBL31204112

SCHEMBL31204112

O=C(Nc1nc2ccc(Br)cn2n1)C1(F)CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PIK3CG P48736 10/20 0.41
▸ PIK3CA P42336 7/20 0.41
▸ AHR P35869 7/20 0.40
▸ PIK3CD O00329 4/20 0.39
▸ PIK3CB P42338 1/20 0.39
▸ JAK2 O60674 1/20 0.38
▸ JAK1 P23458 1/20 0.38
▸ TYK2 P29597 1/20 0.38
▸ JAK3 P52333 1/20 0.38
▸ RIPK1 Q13546 1/20 0.38

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
SCHEMBL968074 0.78 AHR (0.46) PIK3CGPIK3CAAHRPIK3CDPIK3CB
SCHEMBL936127 0.78 PIK3CG (0.63) PIK3CGPIK3CAAHRPIK3CDPIK3CB
SCHEMBL31204146 0.78 JAK2 (0.39) PIK3CGJAK2JAK1TYK2JAK3
SCHEMBL31204259 0.75 MAP3K5 (0.53) PIK3CGPIK3CA
SCHEMBL31204203 0.74 OTUD7B (0.47) PIK3CGPIK3CAPIK3CDPIK3CB
SCHEMBL2771935 0.74 TTK (0.62) PIK3CGAHR
SCHEMBL31204072 0.71 JAK2 (0.34) JAK2JAK1TYK2JAK3
SCHEMBL16439342 0.70 AHR (0.53) PIK3CGPIK3CAAHRPIK3CDPIK3CB
SCHEMBL31204279 0.69 PIK3CG (0.52) PIK3CGPIK3CAPIK3CDPIK3CB
SCHEMBL2788075 0.69 PIK3CA (0.54) PIK3CGPIK3CA

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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