SCHEMBL745940

SCHEMBL745940

COc1[c]c(OC)c(F)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
SCHEMBL160918 0.79
SCHEMBL2347552 0.79
SCHEMBL2351997 0.76 HTR2A (0.32)
SCHEMBL2345890 0.76 HTR2A (0.32)
SCHEMBL28926421 0.75 RAB9A (0.34)
SCHEMBL748238 0.74
SCHEMBL161217 0.74 CA2 (0.36)
SCHEMBL315488 0.73 KDM4E (0.35)
SCHEMBL20489989 0.72 APP (0.31)
SCHEMBL28410485 0.70 TAAR1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101511798-A [4, 5 '] bipyrimidinyl-6, 4' -diamine derivatives as protein kinase inhibitors IRM LLC (VG) 2009-08-19 CN claimed
CN-105899554-B It is used to prepare the method for propylene terpolymers and thus obtained terpolymer 巴塞尔聚烯烃意大利有限公司 2018-07-27 CN disclosed
CN-103073661-B Magnesium dichloride-based adduct and catalytic component prepared therefrom 巴塞尔聚烯烃意大利有限公司 2018-06-12 CN disclosed
CN-105143528-B Polypropylene fibre 巴塞尔聚烯烃意大利有限公司 2018-02-13 CN disclosed
CN-105408112-B Heat-sealable polyolefins film and sheet material 巴塞尔聚烯烃意大利有限公司 2018-01-19 CN disclosed
CN-107129549-A Ingredient of solid catalyst, catalyst and application for olefinic polymerization 中国石油化工股份有限公司 2017-09-05 CN disclosed
CN-107129547-A Ingredient of solid catalyst, catalyst and application for olefinic polymerization 中国石油化工股份有限公司 2017-09-05 CN disclosed
CN-107043491-A Process for preparing impact resistant propylene polymer compositions 巴塞尔聚烯烃意大利有限责任公司 2017-08-15 CN disclosed
US-9242970-B2 Lactam derivatives useful as orexin receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2016-01-26 US disclosed
EP-2638008-B1 LACTAM DERIVATIVES USEFUL AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2015-07-01 EP disclosed
WO-2012063207-A1 LACTAM DERIVATIVES USEFUL AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2012-05-18 WO disclosed
US-20120101111-A1 NOVEL OXAZOLIDINONE DERIVIATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2012-04-26 US disclosed
US-20120088759-A1 THIAZOLIDIN-4-ONE AND [1,3]-THIAZINAN-4-ONE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2012-04-12 US disclosed
CN-102413828-A Thiazolidin-4-one and [1,3] -thiazinan-4-one compounds as orexin receptor antagonists ACTELION PHARMACEUTICALS LTD 2012-04-11 CN disclosed
CN-102414184-A Novel oxazolidinone derivatives and their use as orexin receptor antagonists ACTELION PHARMACEUTICALS LTD 2012-04-11 CN disclosed
EP-2429523-A1 THIAZOLIDIN-4-ONE AND [1,3]-THIAZINAN-4-ONE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS Actelion Pharmaceuticals Ltd. (CH) 2012-03-21 EP disclosed
EP-2430004-A2 NOVEL OXAZOLIDINONE DERIVATIVES AND THEIR USE AS OREXIN RECEPTOR ANTAGONISTS Actelion Pharmaceuticals Ltd. (CH) 2012-03-21 EP disclosed
WO-2010131191-A1 THIAZOLIDIN-4-ONE AND [1,3]-THIAZINAN-4-ONE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2010-11-18 WO disclosed
WO-2010131192-A2 NOVEL OXAZOLIDINONE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2010-11-18 WO disclosed
CN-1171394-A New urea derivatives, their preparation and their therapeutic and prophylactic use SANKYO CO (JP) 1998-01-28 CN disclosed