SCHEMBL30709077

SCHEMBL30709077

CCOC(=O)c1oc2ccc(S(=O)(=O)NCCc3cncc(Br)c3)cc2c1C

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 14/20 0.57
▸ PARG Q86W56 2/20 0.56
▸ MAPT P10636 1/20 0.49
▸ USP2 O75604 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ STAT3 P40763 1/20 0.49
▸ STAT1 P42224 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ HPGD P15428 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47

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
SCHEMBL26603295 1.00 HIF1A (0.57) HIF1APARGMAPTUSP2LMNA
SCHEMBL30709152 0.89 GAA (0.60) HIF1APARGUSP2SMN1; SMN2HPGD
SCHEMBL26603376 0.89 GAA (0.60) HIF1APARGUSP2SMN1; SMN2HPGD
SCHEMBL26603368 0.89 PARG (0.55) HIF1APARGMAPTUSP2LMNA
SCHEMBL30709093 0.89 PARG (0.55) HIF1APARGMAPTUSP2LMNA
SCHEMBL26603441 0.88 HIF1A (0.67) HIF1APARGMAPTUSP2LMNA
SCHEMBL30709163 0.88 HIF1A (0.67) HIF1APARGMAPTUSP2LMNA
SCHEMBL26603278 0.88 HIF1A (0.66) HIF1APARGUSP2LMNAMAPK1
SCHEMBL30709189 0.87 HIF1A (0.66) HIF1APARGUSP2LMNAMAPK1
SCHEMBL26603304 0.87 HIF1A (0.66) HIF1APARGUSP2LMNAMAPK1

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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