SCHEMBL380209

SCHEMBL380209

FC1=CC=CC[CH]1

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
SCHEMBL784939 0.65
SCHEMBL743705 0.65
SCHEMBL8688636 0.65
SCHEMBL1666716 0.65
SCHEMBL976280 0.65
SCHEMBL398311 0.65
SCHEMBL775060 0.65
SCHEMBL1082862 0.65
SCHEMBL19993292 0.64
SCHEMBL7179079 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2807161-A1 TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES Merck Patent GmbH (DE) 2014-12-03 EP claimed
WO-2014066506-A2 COMPOSITIONS AND METHODS FOR JAMM PROTEIN INHIBITION CLEAVE BIOSCIENCES, INC. (US) 2014-05-01 WO claimed
WO-2014002110-A1 SUBSTITUTUED PYRAZOLE COMPOUNDS AND PROCESS FOR PREPARATION THEREOF. RALLIS INDIA LIMITED (IN) 2014-01-03 WO claimed
WO-2013110309-A1 TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2013-08-01 WO claimed
EP-1747206-A1 AMINO-TETRAZOLES ANALOGUES AND METHODS OF USE ABBOTT LABORATORIES (US) 2007-01-31 EP claimed
WO-2007005510-A1 N-HETEROARYLPIPERAZINYL UREAS AS MODULATORS OF FATTY ACID AMIDE HYDROLASE JANSSEN PHARMACEUTICA N.V. (BE) 2007-01-11 WO claimed
WO-2005111003-A1 AMINO-TETRAZOLES ANALOGUES AND METHODS OF USE ABBOTT LABORATORIES (US) 2005-11-24 WO claimed
EP-3302465-A1 TRIAZOLES FOR THE TREATMENT OF DEMYELINATING DISEASES Vertex Pharmaceuticals Incorporated (US) 2018-04-11 EP disclosed
WO-2017168438-A1 PROCESS FOR PREPARING PURE ALLYL PROTECTED KETO DERIVATIVE IND-SWIFT LABORATORIES LIMITED (IN) 2017-10-05 WO disclosed
US-9751858-B2 3-heteroaroylamino-propionic acid derivatives and their use as pharmaceuticals SANOFI (FR) 2017-09-05 US disclosed
WO-2016197009-A1 TRIAZOLES FOR THE TREATMENT OF DEMYELINATING DISEASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2016-12-08 WO disclosed
US-20160237060-A1 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICALS SANOFI (FR) 2016-08-18 US disclosed
EP-3024829-A1 VASOPRESSIN-2 RECEPTOR AGONISTS Ferring B.V. (NL) 2016-06-01 EP disclosed
EP-0256981-A2 Titanocenes and their use CIBA-GEIGY AG (CH) 1988-02-24 EP disclosed
EP-0186626-A2 Titanocenes and compositions curable by irradiation containing these titanocenes CIBA-GEIGY AG (CH) 1986-07-02 EP disclosed
EP-0185651-A1 Intermediates for the production of antibacterial penem derivates HOECHST UK LIMITED (GB) 1986-06-25 EP disclosed
US-4559346-A Certain N-octahydro-indolizinebenzamides and their use in treating psychosis, cardiac arrhythmia and hypertension BEECHAM GROUP P.L.C. (GB) 1985-12-17 US disclosed
US-4550111-A BETA-ADRENERGIC BLOCKING AGENTS; DIURETICS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-10-29 US disclosed
EP-0127412-A2 Imidazolidinedione derivatives PFIZER INC. (US) 1984-12-05 EP disclosed
EP-0094744-A1 Azabicyclobenzamides, their preparation and their pharmaceutical compositions BEECHAM GROUP PLC (GB) 1983-11-23 EP disclosed