SCHEMBL6624317

SCHEMBL6624317

[CH2]C(Br)C(Cl)CC=C

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
SCHEMBL28436968 0.72
SCHEMBL9445653 0.69
SCHEMBL10745017 0.69
SCHEMBL11744345 0.67
SCHEMBL6052975 0.65
SCHEMBL10770048 0.65
SCHEMBL2136788 0.65
Hydrogen Sulfide SCHEMBL2511821 0.63
Ammonia Solution, Strong SCHEMBL3855127 0.63
Hydrogen Sulfide SCHEMBL11883412 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0942722-B1 TETRAHYDRO-BETA-CARBOLINE COMPOUNDS LILLY CO ELI (US) 2004-05-19 EP disclosed
EP-0942722-A4 TETRAHYDRO-BETA-CARBOLINE COMPOUNDS LILLY CO ELI (US) 2002-06-05 EP disclosed
EP-1098883-A4 PROCESS FOR PREPARING HETEROCYCLIC COMPOUNDS LILLY CO ELI (US) 2001-11-14 EP disclosed
EP-0749313-A4 METHOD FOR TREATING 5HT 2B RECEPTOR RELATED CONDITIONS LILLY CO ELI (US) 2001-10-24 EP disclosed
EP-0983269-A4 PROCESS FOR PREPARING HETEROCYCLIC COMPOUNDS LILLY CO ELI (US) 2001-06-27 EP disclosed
EP-1098883-A1 PROCESS FOR PREPARING HETEROCYCLIC COMPOUNDS ELI LILLY AND COMPANY (US) 2001-05-16 EP disclosed
US-6194416-B1 CENTRAL NERVOUS SYSTEM DISORDERS; ALZHEIMER'S DISEASE ELI LILLY AND COMPANY 2001-02-27 US disclosed
US-6187776-B1 AZACYCLIC-SUBSTITUTED PYRIDINE DERIVATIVES; ALZHEIMER*S DISEASE, SCHIZOPHRENIA, GASTROINTESTINAL DISORDERS; COGNITION ACTIVATORS ELI LILLY AND COMPANY 2001-02-13 US disclosed
EP-0788489-A4 HETEROCYCLIC COMPOUNDS AND THEIR USE LILLY CO ELI (US) 2000-11-15 EP disclosed
US-6090945-A HIGH AFFINITY FOR THE 5-HT1C RECEPTOR. ELI LILLY AND COMPANY (US) 2000-07-18 US disclosed
EP-0745601-A1 Process for preparing 1,2,5-thiadiazole derivatives ELI LILLY AND COMPANY (US) 1996-12-04 EP disclosed
WO-1996024351-A1 TETRAHYDRO-BETA-CARBOLINES, OCTAHYDRO-INDOLO-[2,3-c]QUINOLINES AND OCTAHYDRO-INDOLO-[2,3-c]-QUINUCLIDINES ELI LILLY AND COMPANY (US) 1996-08-15 WO disclosed
WO-1996012711-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE ELI LILLY AND COMPANY (US) 1996-05-02 WO disclosed
EP-0709381-A1 Heterocyclic compounds and their preparation and use ELI LILLY AND COMPANY (US) 1996-05-01 EP disclosed
US-5508284-A TREATING 5-HYDROXYTRYPTAMINE MODULATION ELI LILLY AND COMPANY (US) 1996-04-16 US disclosed
US-5500431-A ANTISEROTONINE AGENTS; SEXUAL AND EATING DISORDERS ELI LILLY AND COMPANY (US) 1996-03-19 US disclosed
WO-1995024200-A1 METHOD FOR TREATING 5HT2B RECEPTOR RELATED CONDITIONS ELI LILLY AND COMPANY (US) 1995-09-14 WO disclosed
WO-1995024191-A1 8-SUBSTITUTED TETRAHYDRO-BETA-CARBOLINES ELI LILLY AND COMPANY (US) 1995-09-14 WO disclosed
WO-1994023720-A1 TETRAHYDRO-BETA-CARBOLINES ELI LILLY AND COMPANY (US) 1994-10-27 WO disclosed
EP-0620222-A2 Tetrahydro-beta-carbolines ELI LILLY AND COMPANY (US) 1994-10-19 EP disclosed