SCHEMBL30709175

SCHEMBL30709175

CCOC(=O)c1oc2cc(S(=O)(=O)NCCc3ccccc3)ccc2c1C

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 9/20 0.53
▸ GAA P10253 1/20 0.53
▸ PARG Q86W56 2/20 0.52
▸ ALDH1A1 P00352 4/20 0.51
▸ TP53 P04637 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ PKM P14618 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ RECQL P46063 1/20 0.49
▸ LMNA P02545 1/20 0.48

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
SCHEMBL26603271 1.00 HIF1A (0.53) HIF1AGAAPARGALDH1A1TP53
SCHEMBL24641448 0.92 GAA (0.63) HIF1AGAAPARGALDH1A1LMNA
SCHEMBL30017496 0.92 GAA (0.63) HIF1AGAAPARGALDH1A1LMNA
SCHEMBL30709111 0.89 GAA (0.66) GAAALDH1A1TSHRPKML3MBTL1
SCHEMBL26603475 0.89 GAA (0.66) GAAALDH1A1TSHRPKML3MBTL1
SCHEMBL30709171 0.85 GAA (0.60) HIF1AGAAPARGALDH1A1TP53
SCHEMBL26603395 0.85 GAA (0.60) HIF1AGAAPARGALDH1A1TP53
SCHEMBL26603606 0.85 GAA (0.57) HIF1AGAAPARGLMNA
SCHEMBL26603578 0.83 HIF1A (0.65) HIF1AGAAPARGALDH1A1LMNA
SCHEMBL26603484 0.83 PARG (0.62) HIF1AGAAPARGALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116903563-A GPCR modulators and uses thereof 北京昌平实验室 2023-10-20 — — CN disclosed
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