SCHEMBL26603402

SCHEMBL26603402

CCOC(=O)c1oc2ccc(S(=O)(=O)NCCc3ccc(OC)cc3)cc2c1C

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.66
▸ PARG Q86W56 2/20 0.60
▸ HIF1A Q16665 8/20 0.58
▸ SMN1; SMN2 Q16637 3/20 0.56
▸ LMNA P02545 2/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ HPGD P15428 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ USP2 O75604 2/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ STAT3 P40763 1/20 0.52
▸ STAT1 P42224 1/20 0.52
▸ MAPT P10636 1/20 0.51
▸ AKR1C3 P42330 1/20 0.51

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
SCHEMBL30709080 0.93 PARG (0.60) ALDH1A1PARGHIF1ASMN1; SMN2LMNA
SCHEMBL26603361 0.93 PARG (0.60) ALDH1A1PARGHIF1ASMN1; SMN2LMNA
SCHEMBL26603484 0.90 PARG (0.62) ALDH1A1PARGHIF1ASMN1; SMN2LMNA
SCHEMBL26603266 0.90 PARG (0.57) ALDH1A1PARGHIF1ASMN1; SMN2LMNA
SCHEMBL30709059 0.90 PARG (0.57) ALDH1A1PARGHIF1ASMN1; SMN2LMNA
SCHEMBL30709163 0.90 HIF1A (0.67) ALDH1A1PARGHIF1ASMN1; SMN2LMNA
SCHEMBL30709089 0.90 PARG (0.61) ALDH1A1PARGHIF1ASMN1; SMN2LMNA
SCHEMBL26603441 0.90 HIF1A (0.67) ALDH1A1PARGHIF1ASMN1; SMN2LMNA
SCHEMBL30709112 0.90 PARG (0.61) ALDH1A1PARGHIF1ASMN1; SMN2LMNA
SCHEMBL26603242 0.90 HIF1A (0.67) ALDH1A1PARGHIF1ASMN1; SMN2LMNA

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
WO-2023202582-A1 GPCR REGULATOR AND USE THEREOF 北京昌平实验室 2023-10-26 — — WO disclosed
Send feedback