SCHEMBL1930876

SCHEMBL1930876

CC(C)C1OC[CH]CO1

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
SCHEMBL8976818 0.83
SCHEMBL4462479 0.82
SCHEMBL3079746 0.71
SCHEMBL13483440 0.71
SCHEMBL23376902 0.71
SCHEMBL3195059 0.67
SCHEMBL14778061 0.67
SCHEMBL7170470 0.67
SCHEMBL6983611 0.65 MEN1 (0.31)
SCHEMBL19979162 0.65 NOS3 (0.31)

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7399761-B2 Phthalazine derivatives with angiogenesis inhibiting activity NOVARTIS AG (CH) 2008-07-15 US claimed
US-20040180899-A1 Phthalazine derivatives with angiogenesis inhibiting activity NOVARTIS AG (CH) 2004-09-16 US claimed
EP-1387836-A1 PHTHALAZINE DERIVATIVES WITH ANGIOGENESIS INHIBITING ACTIVITY Novartis AG (CH) 2004-02-11 EP claimed
WO-2002090346-A1 PHTHALAZINE DERIVATIVES WITH ANGIOGENESIS INHIBITING ACTIVITY NOVARTIS AG (CH) 2002-11-14 WO claimed
US-8034814-B2 Phthalazine derivatives with angiogenesis inhibiting activity NOVARTIS AG (CH) 2011-10-11 US disclosed
US-20110130399-A1 Phthalazine Derivatives with Angiogenesis Inhibiting Activity NOVARTIS AG (CH) 2011-06-02 US disclosed
US-20090076003-A1 Phthalazine Derivatives with Angiogenesis Inhibiting Activity NOVARTIS AG 2009-03-19 US disclosed
US-7399761-B2 Phthalazine derivatives with angiogenesis inhibiting activity NOVARTIS AG (CH) 2008-07-15 US disclosed
US-20040180899-A1 Phthalazine derivatives with angiogenesis inhibiting activity NOVARTIS AG (CH) 2004-09-16 US disclosed
EP-1387836-A1 PHTHALAZINE DERIVATIVES WITH ANGIOGENESIS INHIBITING ACTIVITY Novartis AG (CH) 2004-02-11 EP disclosed
WO-2002090346-A1 PHTHALAZINE DERIVATIVES WITH ANGIOGENESIS INHIBITING ACTIVITY NOVARTIS AG (CH) 2002-11-14 WO disclosed
US-5633268-A FUNGICIDES, INSECTICIDES, PESTICIDES BASF AKTIENGESELLSCHAFT (DE) 1997-05-27 US disclosed
EP-0309913-B1 Fungicidal N-substituted 3-aryl-pyrrolidine derivatives BASF AG (DE) 1994-06-15 EP disclosed
US-5068245-A For treatment of plants BASF AKTIENGESELLSCHAFT (DE) 1991-11-26 US disclosed
EP-0309913-A2 Fungicidal N-substituted 3-aryl-pyrrolidine derivatives BASF Aktiengesellschaft (DE) 1989-04-05 EP disclosed
EP-0081207-A2 Aniline derivatives, process for their preparation and their use as herbicides BASF Aktiengesellschaft (DE) 1983-06-15 EP disclosed