SCHEMBL2808909

SCHEMBL2808909

OCc1cc(O)cc(OCc2ccccc2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 1/20 0.58
CYP1A2 P05177 2/20 0.58
CYP1A1 P04798 1/20 0.58
CYP19A1 P11511 1/20 0.58
LMNA P02545 1/20 0.56
PTGS1 P23219 1/20 0.56
SLC6A2 P23975 1/20 0.56
CYP2C19 P33261 1/20 0.56
PTGS2 P35354 1/20 0.56
SLC6A3 Q01959 1/20 0.56
HIF1A Q16665 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
CYP4F2 P78329 1/20 0.56
CYP4A11 Q02928 1/20 0.56
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
TSHR P16473 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
ALOX5 P09917 1/20 0.49
ACHE P22303 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
SCHEMBL3271153 0.91 CYP4F2 (0.61) CYP1A2CYP1A1CYP19A1LMNAPTGS1
SCHEMBL4910012 0.91 MEN1 (0.62) CYP1A2CYP1A1CYP19A1LMNAPTGS1
SCHEMBL14601810 0.89 MEN1 (0.61) CYP1A2CYP1A1CYP19A1LMNAPTGS1
SCHEMBL1834526 0.87 CYP1A2 (0.67) CYP1A2CYP1A1CYP19A1LMNAPTGS1
SCHEMBL2007390 0.87 CYP1A2 (0.67) CYP1A2CYP1A1CYP19A1LMNAPTGS1
SCHEMBL28298170 0.86 CYP1A2 (0.58) CYP1A2CYP1A1CYP19A1LMNAPTGS1
SCHEMBL214947 0.84 MAOB (0.59) CYP1A2CYP1A1CYP19A1LMNAPTGS1
SCHEMBL7316282 0.83 MRGPRX4 (0.54) CYP1A2LMNAPTGS1SLC6A2CYP2C19
SCHEMBL6035513 0.83 MAOB (0.65) CYP1A2LMNAPTGS1SLC6A2CYP2C19
SCHEMBL22071025 0.83 MAOB (0.60) CYP1A2CYP1A1CYP19A1LMNAPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114773989-A Anti-silver colloid diffusion agent, preparation method and application thereof 苏州瑞港环保科技有限公司 2022-07-22 CN claimed
CN-114773989-A Anti-silver colloid diffusion agent, preparation method and application thereof 苏州瑞港环保科技有限公司 2022-07-22 CN disclosed
US-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators SMITHKLINE BEECHAM CORPORATION (US) 2010-09-23 US disclosed
US-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators SMITHKLINE BEECHAM CORPORATION (US) 2010-09-23 US disclosed
US-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators SMITHKLINE BEECHAM CORPORATION (US) 2010-09-23 US disclosed
EP-2081894-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SmithKline Beecham Corporation (US) 2009-07-29 EP disclosed
WO-2008028118-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SMITHKLINE BEECHAM CORPORAITON (US) 2008-03-06 WO disclosed
WO-2008028118-A1 1H-INDOLE-2-CARBOXYLIC ACID DERIVATIVES USEFUL AS PPAR MODULATORS SMITHKLINE BEECHAM CORPORAITON (US) 2008-03-06 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-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators PPARD, PPARA, PPARG GPBAR1 82/4885CYP1A2 216/4885CYP1A1 255/4885

“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.