SCHEMBL27567559

SCHEMBL27567559

[CH2]C1CCCC1c1ccc(S(C)(=O)=O)c(Br)c1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRIA4 P48058 4/20 0.35
▸ GRIA2 P42262 1/20 0.35
▸ LMNA P02545 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ PIK3CD O00329 1/20 0.30
▸ PIK3CA P42336 1/20 0.30
▸ PIK3CB P42338 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
SCHEMBL2645256 0.72 TSHR (0.33) LMNAHPGDTSHRPIK3CDPIK3CA
SCHEMBL27466732 0.72 HDAC8 (0.41) —
SCHEMBL27466234 0.69 GCK (0.33) GRIA4
SCHEMBL2646368 0.65 HSP90AA1 (0.43) LMNAPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL30085302 0.65 HSP90AA1 (0.43) LMNAPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL15478494 0.63 L3MBTL1 (0.44) LMNATSHRPIK3CDPIK3CAPIK3CB
SCHEMBL7017664 0.63 ALDH1A3 (0.46) HPGDTSHRPIK3CDPIK3CAPIK3CB
SCHEMBL27502624 0.63 PIK3CD (0.33) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL23001810 0.62 ENPP2 (0.45) LMNAHPGDPIK3CDPIK3CAPIK3CB
SCHEMBL12496190 0.62 L3MBTL1 (0.62) HPGDTSHRPIK3CDPIK3CAPIK3CB

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
CN-1226294-C Fused heteroaromatic glucokinase activators HOFFMANN LA ROCHE (CH) 2005-11-09 — — CN disclosed
CN-1476438-A Fused heteroaromatic glucokinase activators - 2004-02-18 — — CN disclosed
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