SCHEMBL2882249

SCHEMBL2882249

C[C@H](CNc1ccccn1)N1CCN(c2cccc3c2OCCO3)CC1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 8/20 0.55

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
SCHEMBL2882258 1.00 HTR1A (0.55) HTR1A
SCHEMBL14198662 1.00 HTR1A (0.55) HTR1A
SCHEMBL8010266 0.80 HTR1A (0.55) HTR1A
SCHEMBL13632840 0.80 HTR1A (0.55) HTR1A
Hydrochloric Acid SCHEMBL4633314 0.79 HTR1A (0.60) HTR1A
SCHEMBL8013988 0.78 DRD2 (0.63) HTR1A
SCHEMBL14262563 0.78 ADRB1 (0.56) HTR1A
SCHEMBL14262669 0.78 ADRB1 (0.56) HTR1A
SCHEMBL4975881 0.77 ADRB1 (0.55) HTR1A
SCHEMBL4975887 0.77 ADRB1 (0.55) HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1730139-A2 PHARMACEUTICAL DOSAGE FORMS AND COMPOSITIONS OF 5-HT1A RECEPTOR ANTAGONISTS Wyeth (US) 2006-12-13 EP claimed
WO-2005092307-A2 PHARMACEUTICAL DOSAGE FORMS AND COMPOSITIONS OF 5-HT1A RECEPTOR ANTAGONISTS WYETH (US) 2005-10-06 WO claimed
US-20050215561-A1 Pharmaceutical dosage forms and compositions WYETH LLC 2005-09-29 US claimed
US-7816362-B2 Serotonergic agents WYETH LLC (US) 2010-10-19 US disclosed
US-20090215794-A1 SEROTONERGIC AGENTS WYETH (US) 2009-08-27 US disclosed
EP-1971337-A1 SEROTONERGIC AGENTS FOR TREATING SEXUAL DYSFUNCTION Wyeth a Corporation of the State of Delaware (US) 2008-09-24 EP disclosed
US-7425558-B2 -4-substituted-N-(2-(4-(2,3-dihydro-benzo(1,4)dioxin-5-yl)-piperazin -1-yl)propy l)-N-pyridin-2-yl-benzamide or salts; 5-HT1A receptor antagonists; urinary incontinence WYETH (US) 2008-09-16 US disclosed
EP-1928863-A2 PHARMACEUTICAL DOSAGE FORMS AND COMPOSITIONS COMPRISING LECOZTAN Wyeth a Corporation of the State of Delaware (US) 2008-06-11 EP disclosed
US-20080070925-A1 SEROTONERGIC AGENTS FOR TREATING SEXUAL DYSFUNCTION WYETH LLC 2008-03-20 US disclosed
WO-2007081374-A1 SEROTONERGIC AGENTS FOR TREATING SEXUAL DYSFUNCTION WYETH (US) 2007-07-19 WO disclosed
US-20070099931-A1 Pharmaceutical dosage forms and compositions WYETH (US) 2007-05-03 US disclosed
US-20050215561-A1 Pharmaceutical dosage forms and compositions WYETH LLC 2005-09-29 US disclosed
EP-1339406-B1 PIPERAZINE DERIVATIVES, THEIR PREPARATION AND THEIR USE FOR TREATING CENTRAL NERVOUS SYSTEM (CNS) DISORDERS WYETH CORP (US) 2004-06-16 EP disclosed
US-20030216408-A1 Serotonergic agents WYETH 2003-11-20 US disclosed
EP-1339406-A2 PIPERAZINE DERIVATIVES, THEIR PREPARATION AND THEIR USE FOR TREATING CENTRAL NERVOUS SYSTEM (CNS) DISORDERS Wyeth (US) 2003-09-03 EP disclosed
US-6586436-B2 4-(Cyano,nitro,trifluoromethyl or halogen)-N-(2-(4-(2,3-dihydro-benzo(1,4)dioxin-5-yl)-piperazin-1-yl)-propyl)-N-pyridin-2-yl-benzamide; central nervous system disorders WYETH 2003-07-01 US disclosed
US-20030022901-A1 Serotonergic agents WYETH 2003-01-30 US disclosed
US-6469007-B2 P-SUBSTITUTED-N-(2-(4-(2,3-DIHYDRO-BENZO(1,4)DIOXIN-5-YL) -PIPERAZIN-1-YL)-PROPYL)-N-PYRIDIN-2-YL-BENZAMIDE, WYETH 2002-10-22 US disclosed
US-20020107254-A1 P-substituted-N-(2-(4-(2,3-dihydro-benzo(1,4)dioxin-5-yl) -piperazin-1-yl)-propyl)-N-pyridin-2-yl-benzamide, AMERICAN HOME PRODUCTS CORPORATION 2002-08-08 US disclosed
WO-2002044142-A2 PIPERAZINE DERIVATIVES, THEIR PREPARATION AND THEIR USE FOR TREATING CENTRAL NERVOUS SYSTEM (CNS) DISORDERS WYETH (US) 2002-06-06 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 (7 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-20020107254-A1 P-substituted-N-(2-(4-(2,3-dihydro-benzo(1,4)dioxin-5-yl) -piperazin-1-yl)-propyl)-N-pyridin-2-yl-benzamide, HTR1A, HTR1D, HTR2A HTR1A 1/4885
US-20030216408-A1 Serotonergic agents HTR1A, HTR1D, TPH1 HTR1A 1/4885
US-20070099931-A1 Pharmaceutical dosage forms and compositions CYP4B1, CYP1B1, CFTR HTR1A 533/4885
US-20050215561-A1 Pharmaceutical dosage forms and compositions CFTR, CYP4B1, CYP1B1 HTR1A 616/4885
US-20090215794-A1 SEROTONERGIC AGENTS HTR5A, HTR1A, HTR3A HTR1A 2/4885
US-20080070925-A1 SEROTONERGIC AGENTS FOR TREATING SEXUAL DYSFUNCTION HTR5A, HTR1A, HTR3A HTR1A 2/4885
US-20030022901-A1 Serotonergic agents HTR1A, HTR1D, TPH1 HTR1A 1/4885

“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.