SCHEMBL3469772

SCHEMBL3469772

C1=Cn2ccc3cccc(c32)C=N1

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
SCHEMBL29872697 0.71
SCHEMBL4501824 0.70
SCHEMBL4502639 0.64 PARP1 (0.31)
SCHEMBL4892208 0.60 PARP1 (0.40)
SCHEMBL5652264 0.59
SCHEMBL18440765 0.59 ALDH1A1 (0.36)
SCHEMBL2405951 0.59 TRPA1 (0.32)
SCHEMBL2405953 0.59 TRPA1 (0.32)
SCHEMBL4908709 0.57 P2RX4 (0.31)
SCHEMBL11667029 0.57 LMNA (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1998782-A2 METHODS FOR MODULATING BLADDER FUNCTION Wyeth a Corporation of the State of Delaware (US) 2008-12-10 EP claimed
EP-1998780-A2 NEW THERAPEUTIC COMBINATIONS FOR THE TREATMENT OR PREVENTION OF PSYCHOTIC DISORDERS Wyeth a Corporation of the State of Delaware (US) 2008-12-10 EP claimed
EP-1998773-A2 NEW THERAPEUTIC COMBINATIONS FOR THE TREATMENT OF DEPRESSION Wyeth a Corporation of the State of Delaware (US) 2008-12-10 EP claimed
EP-1998781-A2 TREATMENT OF PAIN Wyeth a Corporation of the State of Delaware (US) 2008-12-10 EP claimed
WO-2007112014-A2 NEW THERAPEUTIC COMBINATIONS FOR THE TREATMENT OF DEPRESSION WYETH (US) 2007-10-04 WO claimed
WO-2007112073-A2 METHODS FOR MODULATING BLADDER FUNCTION WYETH (US) 2007-10-04 WO claimed
WO-2007112000-A2 TREATMENT OF PAIN WYETH (US) 2007-10-04 WO claimed
WO-2007111983-A2 NEW THERAPEUTIC COMBINATIONS FOR THE TREATMENT OR PREVENTION OF PSYCHOTIC DISORDERS WYETH (US) 2007-10-04 WO claimed
EP-0785789-B1 DIAZEPINO-INDOLES AS PHOSPHODIESTERASE IV INHIBITORS PFIZER (FR) 2002-09-11 EP claimed
US-20020119967-A1 Pharmaceutical composition for preventing or treating a disease associated with an excess of IL-12-production WARNER-LAMBERT COMPANY 2002-08-29 US claimed
EP-1199074-A1 Pharmaceutical composition for preventing or treating a disease associated with an excess of il-12 production WARNER-LAMBERT COMPANY (US) 2002-04-24 EP claimed
US-20110294792-A1 PURINE DERIVATIVES AS KINASE INHIBITORS ELI LILLY AND COMPANY (US) 2011-12-01 US disclosed
US-20100086921-A1 GENETIC SUSCEPTIBILITY VARIANTS OF TYPE 2 DIABETES MELLITUS SAGA INVESTMENTS LLC 2010-04-08 US disclosed
EP-2015749-A2 METHODS FOR TREATING COGNITIVE AND OTHER DISORDERS Wyeth (US) 2009-01-21 EP disclosed
EP-1998781-A2 TREATMENT OF PAIN Wyeth a Corporation of the State of Delaware (US) 2008-12-10 EP disclosed
EP-0828742-B1 DIAZEPINO-INDOLES AS PHOSPHODIESTERASE IV INHIBITORS JOUVEINAL INST RECH (FR) 2001-12-19 EP disclosed
EP-1161950-A1 Use of diazepinoindoles for the treatment of chronic obstructive pulmonary disease WARNER-LAMBERT COMPANY (US) 2001-12-12 EP disclosed
EP-1161949-A1 Use od diazepinoindoles for the treatment of chronic obstructive pulmonary disease WARNER-LAMBERT COMPANY (US) 2001-12-12 EP disclosed
EP-1132390-A2 Diazepinoindoles as phophodiesterase inhibitors INSTITUT DE RECHERCHE JOUVEINAL (FR) 2001-09-12 EP disclosed
US-5972927-A ANTIINFLAMMATORY, ANTIALLERGIC AND BRONCHODILATORY MEDICINAL PRODUCTS, TREATMENT OF ASTHMA JOUVEINAL (FR) 1999-10-26 US disclosed