SCHEMBL106439

SCHEMBL106439

[c]1cccc2c1CCOO2

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ITGB2 P05107 1/20 0.30
▸ ICAM1 P05362 1/20 0.30
▸ ITGAL P20701 1/20 0.30

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
SCHEMBL103524 0.79 — —
SCHEMBL323509 0.79 — —
SCHEMBL130778 0.72 ITGB2 (0.39) ITGB2ICAM1ITGAL
SCHEMBL9466531 0.68 — —
SCHEMBL4753114 0.67 — —
SCHEMBL4753165 0.67 — —
SCHEMBL29788643 0.66 MAOA (0.41) ITGB2ICAM1ITGAL
SCHEMBL895328 0.66 MAOA (0.41) ITGB2ICAM1ITGAL
SCHEMBL29788642 0.66 MAOA (0.41) ITGB2ICAM1ITGAL
SCHEMBL107468 0.66 MAOA (0.41) ITGB2ICAM1ITGAL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1483255-B1 PROCESS FOR SYNTHESIZING CHIRAL N-ARYL PIPERAZINES WYETH CORP (US) 2009-08-12 — — EP claimed
US-7256289-B2 Process for making chiral 1,4-disubstituted piperazines WYETH (US) 2007-08-14 — — US claimed
US-7091349-B2 Process for synthesizing N-aryl piperazines with chiral N′-1-[benzoyl(2-pyridyl)amino]-2-propane substitution WYETH (US) 2006-08-15 — — US claimed
US-7019137-B2 Process for making chiral 1,4-disubstituted piperazines WYETH (US) 2006-03-28 — — US claimed
US-20050228181-A1 Process for making chiral 1,4-disubstituted piperazines WYETH (US) 2005-10-13 — — US claimed
EP-1483256-A2 PROCESS FOR MAKING CHIRAL 1,4-DISUBSTITUTED PIPERAZINES Wyeth (US) 2004-12-08 — — EP claimed
EP-1483255-A1 PROCESS FOR SYNTHESIZING CHIRAL N-ARYL PIPERAZINES Wyeth, A Corporation of the State of Delaware (US) 2004-12-08 — — EP claimed
US-20040230056-A1 Process for synthesizing N-aryl piperazines with chiral N'-1-[benzoyl(2-pyridyl)amino]-2-propane substitution WYETH 2004-11-18 — — US claimed
US-6756370-B1 POTENT 5-HT2A RECEPTOR ANTAGONISTS MERCK PATENT GMBH (DE) 2004-06-29 — — US claimed
US-6713626-B2 Process for synthesizing N-aryl piperazines with chiral N′-1-[benzoyl(2-pyridyl)amino]-2-propane substitution WYETH 2004-03-30 — — US claimed
WO-2003078417-A1 PROCESS FOR SYNTHESIZING CHIRAL N-ARYL PIPERAZINES WYETH, A CORPORATION OF THE STATE OF DELAWARE (US) 2003-09-25 — — WO claimed
WO-2003078420-A2 PROCESS FOR MAKING CHIRAL 1,4-DISUBSTITUTED PIPERAZINES WYETH (US) 2003-09-25 — — WO claimed
US-6344458-B1 CENTRAL NERVOUS SYSTEM DISORDERS AMERICAN HOME PRODUCTS CORPORATION 2002-02-05 — — US claimed
EP-1140838-A1 1, 4-PIPERAZINE DERIVATIVES HAVING 5HT1A RECEPTOR ACTIVITY AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-10 — — EP claimed
EP-1140882-A1 PIPERAZINE ETHYLAMIDE DERIVATIVES WITH 5-HT1A RECEPTOR ACTIVITY AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-10 — — EP claimed
US-20010014680-A1 1,4-piperazine derivatives WYETH 2001-08-16 — — US claimed
US-6255302-B1 NERVOUS SYSTEM, PSYCHOLOGICAL DISORDERS AMERICAN HOME PRODUCTS CORPORATION 2001-07-03 — — US claimed
WO-2000035892-A1 PIPERAZINE ETHYLAMIDE DERIVATIVES WITH 5-HT1A RECEPTOR ACTIVITY AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-22 — — WO claimed
WO-2000035878-A1 1,4-PIPERAZINE DERIVATIVES HAVING 5HT1A RECEPTOR ACTIVITY AMERICAN HOME PRODUCTS CORPORATION (US) 2000-06-22 — — WO claimed
US-5693642-A ANXIOLYTIC AND HYPOTENSIVE AGENTS; ANTIDEPRESSANTS; PSYCHOLOGICAL DISORDERS; CONTROLLERS OF SLEEP/WAKE CYCLE, EATING AND SEXUAL DISORDERS JOHN WYETH & BROTHER LTD. (GB) 1997-12-02 — — US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20040230056-A1 Process for synthesizing N-aryl piperazines with chiral N'-1-[benzoyl(2-pyridyl)amino]-2-propane substitution TPH1, HTR1B, HTR1A ITGB2 1128/4885ICAM1 2829/4885ITGAL 1818/4885
US-20010014680-A1 1,4-piperazine derivatives ADH1A, ADH1C, SNCA ITGB2 2245/4885ICAM1 899/4885ITGAL 3087/4885
US-20050228181-A1 Process for making chiral 1,4-disubstituted piperazines HTR5A, HTR1A, HTR1D ITGB2 2298/4885ICAM1 2401/4885ITGAL 2218/4885

“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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