SCHEMBL2645256

SCHEMBL2645256

CS(=O)(=O)c1ccc(C2[CH]CCC2)cc1Br

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PIK3CD O00329 1/20 0.30
▸ PIK3CA P42336 1/20 0.30
▸ PIK3CB P42338 1/20 0.30
▸ PIK3CG P48736 1/20 0.30
▸ HTT P42858 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
SCHEMBL2652927 0.86 L3MBTL1 (0.35) L3MBTL1
SCHEMBL2645542 0.82 GCK (0.33) L3MBTL1PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2645512 0.79 PIK3CD (0.34) L3MBTL1PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL27567559 0.72 GRIA4 (0.35) TSHRLMNAHPGDPIK3CDPIK3CA
SCHEMBL30085302 0.66 HSP90AA1 (0.43) LMNAL3MBTL1PIK3CDPIK3CAPIK3CB
SCHEMBL2646368 0.66 HSP90AA1 (0.43) LMNAL3MBTL1PIK3CDPIK3CAPIK3CB
SCHEMBL15478494 0.64 L3MBTL1 (0.44) TSHRLMNAL3MBTL1PIK3CDPIK3CA
SCHEMBL27502624 0.64 PIK3CD (0.33) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL23001810 0.63 ENPP2 (0.45) LMNAHPGDL3MBTL1PIK3CDPIK3CA
SCHEMBL29692324 0.63 ENPP2 (0.45) LMNAHPGDL3MBTL1PIK3CDPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020111372-A1 FUSED HETEROAROMATIC GLUCOKINASE ACTIVATORS CORBETT WENDY L (US) 2002-08-15 — — US disclosed
EP-1169312-A2 GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2002-01-09 — — EP disclosed
WO-2000058293-A2 GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2000-10-05 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020111372-A1 FUSED HETEROAROMATIC GLUCOKINASE ACTIVATORS GCKR, GCK, GPR119 TSHR 2607/4885LMNA 4732/4885HPGD 2077/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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