SCHEMBL3703684

SCHEMBL3703684

CC(O)(CN)c1ccc(I)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 1/20 0.40
▸ APP P05067 1/20 0.38
▸ AOC3 Q16853 1/20 0.37
▸ SHBG P04278 1/20 0.33
▸ KIF11 P52732 1/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ ESR1 P03372 1/20 0.32
▸ ESR2 Q92731 1/20 0.32
▸ HPGD P15428 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL3703681 1.00 TAAR1 (0.40) TAAR1APPAOC3SHBGKIF11
SCHEMBL6563465 0.89 AOC3 (0.42) TAAR1AOC3SHBGMEN1KMT2A
Hydrochloric Acid SCHEMBL6561671 0.86 AOC3 (0.41) TAAR1AOC3SHBGMEN1KMT2A
SCHEMBL15142926 0.80 APP (0.39) APPAOC3SHBGMEN1KMT2A
SCHEMBL12015994 0.80 TSHR (0.48) TAAR1AOC3KIF11MEN1KMT2A
SCHEMBL18545312 0.80 APP (0.39) APPAOC3SHBGMEN1KMT2A
SCHEMBL19690199 0.80 APP (0.39) APPAOC3SHBGMEN1KMT2A
SCHEMBL9907013 0.80 APP (0.39) APPAOC3SHBGMEN1KMT2A
SCHEMBL12171 0.79 TAAR1 (0.62) TAAR1APPSHBGKIF11MAPT
SCHEMBL7839746 0.78 HTR2C (0.38) TAAR1AOC3ALDH1A1ALOX15

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010087982-A1 GLUR2 RECEPTOR MODULATORS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2010-08-05 — — WO disclosed
WO-2010087982-A1 GLUR2 RECEPTOR MODULATORS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2010-08-05 — — WO disclosed
US-20090270508-A1 GluR2 receptor modulators NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2009-10-29 — — US disclosed
US-20090270508-A1 GluR2 receptor modulators NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2009-10-29 — — US disclosed
US-20090270508-A1 GluR2 receptor modulators NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2009-10-29 — — US disclosed
EP-1183232-B1 MONOFLUOROALKYL DERIVATIVES LILLY CO ELI (US) 2007-10-03 — — EP disclosed
EP-1183232-B1 MONOFLUOROALKYL DERIVATIVES LILLY CO ELI (US) 2007-10-03 — — EP disclosed
US-7034045-B1 Monofluoroalkyl derivatives ELI LILLY AND COMPANY (US) 2006-04-25 — — US disclosed
CN-1240677-C Monofluoroalkyl derivatives LILLY CO ELI (US) 2006-02-08 — — CN disclosed
EP-1330233-B1 METHOD OF TREATING STROKE LILLY CO ELI (US) 2005-02-02 — — EP disclosed
EP-1292311-A2 COMBINATION THERAPY FOR THE TREATMENT OF DEPRESSION COMPRISING AN ANTIDEPRESSANT AND AN AMPA RECEPTOR POTENTIATOR ELI LILLY AND COMPANY (US) 2003-03-19 — — EP disclosed
WO-2002089848-A2 USE OF AN AMPA RECEPTOR POTENTIATOR FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF TYPE 2 DIABETES ELI LILLY AND COMPANY (US) 2002-11-14 — — WO disclosed
CN-1349497-A Monofluoroalkyl derivatives LILLY CO ELI (US) 2002-05-15 — — CN disclosed
WO-2002032389-A1 METHOD OF TREATING STROKE ELI LILLY AND COMPANY (US) 2002-04-25 — — WO disclosed
WO-2002018329-A1 ACETYLENIC SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2002-03-07 — — WO disclosed
EP-1183232-A2 MONOFLUOROALKYL DERIVATIVES ELI LILLY AND COMPANY (US) 2002-03-06 — — EP disclosed
WO-2002014275-A2 HETEROCYCLIC SULFONAMIDE DERIVATIVES AND THEIR USE FOR POTENTIATING GLUTAMATE RECEPTOR FUNCTION ELI LILLY AND COMPANY (US) 2002-02-21 — — WO disclosed
WO-2001089530-A2 COMBINATION THERAPY FOR TREATMENT OF DEPRESSION COMPRISING AN ANTIDEPRESSANT AND AN AMPA RECEPTOR POTENTIATOR ELI LILLY AND COMPANY (US) 2001-11-29 — — WO disclosed
WO-2001089510-A2 USE OF AN AMPA RECEPTOR POTENTIATOR FOR THE TREATMENT OF OBESITY ELI LILLY AND COMPANY (US) 2001-11-29 — — WO disclosed
WO-2000066546-A2 MONOFLUOROALKYL DERIVATIVES ELI LILLY AND COMPANY (US) 2000-11-09 — — 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-20090270508-A1 GluR2 receptor modulators GRM2, GRIK2, GRIN2A TAAR1 376/4885APP 2410/4885AOC3 4677/4885

“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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