SCHEMBL3634772

SCHEMBL3634772

CC(=O)CCC1CCC(C)(C)C=C1C

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.33
▸ HPGD P15428 1/20 0.32
▸ NPC1 O15118 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL16568697 0.75 — —
SCHEMBL14844436 0.74 ALDH1A1 (0.33) —
SCHEMBL10731461 0.70 PTPN2 (0.33) PTPN1
SCHEMBL1628695 0.70 — —
SCHEMBL11882302 0.70 — —
SCHEMBL5571845 0.67 — —
SCHEMBL17338287 0.67 — —
SCHEMBL8674249 0.67 PTPN2 (0.40) PTPN1
SCHEMBL7557961 0.67 PTPN2 (0.40) PTPN1
SCHEMBL1305369 0.67 PTPN2 (0.40) PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4229165-A1 A SYNERGISTIC PERFUMING COMPOSITION Firmenich SA (CH) 2023-08-23 — — EP claimed
WO-2022129351-A1 A SYNERGISTIC PERFUMING COMPOSITION FIRMENICH SA (CH) 2022-06-23 — — WO claimed
EP-4077260-A1 2,4-DIETHYLOCTA-2,6-DIENAL AND ITS USE AS AROMA CHEMICAL BASF SE (DE) 2022-10-26 — — EP disclosed
EP-4021900-A1 2,2,6-TRIMETHYL-4,5-DIHYDRO-3H-OXEPINE AS AROMA INGREDIENT BASF SE (DE) 2022-07-06 — — EP disclosed
EP-3986995-A1 1-ALKOXYETHYL-4-ISOBUTYL-BENZENE AS AROMA INGREDIENTS BASF SE (DE) 2022-04-27 — — EP disclosed
EP-3898915-A1 SHAPED BODY COMPRISING A POLYETHYLENE GLYCOL GRAFT COPOLYMER AND THE AROMA CHEMICAL BASF SE (DE) 2021-10-27 — — EP disclosed
EP-3890838-A1 MICROCAPSULES Symrise AG (DE) 2021-10-13 — — EP disclosed
WO-2021122684-A1 DODECANDIEN-1-OL AND DODECEN-1-OL OR MIXTURES THEREOF AS AROMA CHEMICALS BASF SE (DE) 2021-06-24 — — WO disclosed
WO-2021122674-A1 2,4-DIETHYLOCTA-2,6-DIENAL AND ITS USE AS AROMA CHEMICAL BASF SE (DE) 2021-06-24 — — WO disclosed
US-20210147895-A1 METHOD OF PRODUCING TERPENES OR TERPENOIDS DEINOVE (FR) 2021-05-20 — — US disclosed
WO-2021037806-A1 2,2,6-TRIMETHYL-4,5-DIHYDRO-3H-OXEPINE AS AROMA INGREDIENT BASF SE (DE) 2021-03-04 — — WO disclosed
EP-2152673-A2 3- TO 7-MEMBERED 1,3-DIAZA-4-OXO-HETEROCYCLIC DERIVATIVES CAPABLE OF RELEASING ACTIVE ALDEHYDES OR KETONES Firmenich S.A. (CH) 2010-02-17 — — EP disclosed
EP-2010293-A2 CONTROLLED RELEASE OF ACTIVE COMPOUNDS FROM DYNAMIC MIXTURES Firmenich S.A. (CH) 2009-01-07 — — EP disclosed
WO-2008142591-A2 3- TO 7-MEMBERED 1,3-DIAZA-4-OXO-HETEROCYCLIC DERIVATIVES CAPABLE OF RELEASING ACTIVE ALDEHYDES OR KETONES FIRMENICH SA (CH) 2008-11-27 — — WO disclosed
EP-1863827-A1 HYDROGELS FOR THE CONTROLLED RELEASE OF BIOACTIVE MATERIALS FIRMENICH SA (CH) 2007-12-12 — — EP disclosed
WO-2007085991-A2 CONTROLLED RELEASE OF ACTIVE COMPOUNDS FROM DYNAMIC MIXTURES FIRMENICH SA (CH) 2007-08-02 — — WO disclosed
WO-2006100647-A1 HYDROGELS FOR THE CONTROLLED RELEASE OF BIOACTIVE MATERIALS FIRMENICH SA (CH) 2006-09-28 — — WO disclosed
EP-1492759-A2 NOVEL ALICYCLIC ESTERS HAVING A MUSKY SMELL Symrise GmbH & Co. KG (DE) 2005-01-05 — — EP disclosed
WO-2003082799-A2 ALICYCLIC ESTERS HAVING A MUSKY SMELL SYMRISE GMBH & CO. KG (DE) 2003-10-09 — — WO disclosed
WO-2002076605-A1 METHOD FOR PRODUCING ENCAPSULATIONS SYMRISE GMBH & CO. KG (DE) 2002-10-03 — — WO disclosed
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