SCHEMBL9526336

SCHEMBL9526336

O=C1C2C3C=CC(C4CC34)C2C(=O)N1CCCCN1CCN(c2cncc(Cl)n2)CC1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL9527365 0.94
SCHEMBL13532600 0.92
SCHEMBL9527873 0.92
SCHEMBL9527435 0.88
SCHEMBL10660956 0.88
SCHEMBL9529768 0.87 ALDH1A1 (0.53)
SCHEMBL10470793 0.87
SCHEMBL9527982 0.86
Hydrochloric Acid SCHEMBL9527324 0.85 ALDH1A1 (0.51)
SCHEMBL10619892 0.84

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
EP-0220873-B1 Fused bicyclic imides with psychotropic activity AMERICAN HOME PROD (US) 1993-11-24 EP claimed
US-4957913-A N-((4-ARYLPIPERAZINO)ALKYL) SUBSTITTUTED AMERICAN HOME PRODUCTS CORP. (US) 1990-09-18 US claimed
US-4892943-A ANTIPSYCHOTIC, ANXIOLYTIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1990-01-09 US claimed
EP-0220873-A1 Fused bicyclic imides with psychotropic activity AMERICAN HOME PRODUCTS CORPORATION (US) 1987-05-06 EP claimed
US-20100009983-A1 5 HT RECEPTOR MEDIATED NEUROGENESIS BRAINCELLS, INC. (US) 2010-01-14 US disclosed
EP-0220873-B1 Fused bicyclic imides with psychotropic activity AMERICAN HOME PROD (US) 1993-11-24 EP disclosed
US-4957913-A N-((4-ARYLPIPERAZINO)ALKYL) SUBSTITTUTED AMERICAN HOME PRODUCTS CORP. (US) 1990-09-18 US disclosed
US-4892943-A ANTIPSYCHOTIC, ANXIOLYTIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1990-01-09 US disclosed