SCHEMBL9621772

SCHEMBL9621772

O=C1CC(O)C=C1Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
PTPN1 P18031 1/20 0.39
CALM1 P0DP23 1/20 0.38
SORT1 Q99523 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
IDH1 O75874 1/20 0.35
TEK Q02763 1/20 0.35
ELANE P08246 1/20 0.35
PLA2G10 O15496 1/20 0.34
PLA2G2A P14555 1/20 0.34
LMNA P02545 1/20 0.34
ALDH1A1 P00352 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
MAPK1 P28482 1/20 0.34
HIF1A Q16665 1/20 0.34
NQO1 P15559 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL11540959 0.81 HDAC1 (0.41) MAPK1
SCHEMBL14537334 0.81 DAO (0.41) MEN1KMT2AALDH1A1KDM4E
SCHEMBL14432659 0.81 CYP4F2 (0.48) MAOAMAOB
SCHEMBL10828258 0.79 MAOA (0.41) MAOAMAOBPTPN1CALM1SORT1
SCHEMBL14432751 0.78 IDH1 (0.45) IDH1ALDH1A1CYP1A2
SCHEMBL14537335 0.78 MAOA (0.32) MAOAMAOBIDH1
SCHEMBL14537340 0.78 MAOA (0.32) MAOAMAOBIDH1
SCHEMBL25835348 0.76 MAOA (0.42) MAOAMAOBPTPN1CALM1MEN1
SCHEMBL21224705 0.72
SCHEMBL21807989 0.71 CYP2C9 (0.37) MEN1KMT2AELANECYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0155819-B1 IMPROVEMENTS RELATING TO PESTICIDES BTG INTERNATIONAL LIMITED (GB) 1992-02-05 EP claimed
EP-2574605-A1 Processes for preparing cyclopentenones and cyclopentenones for the synthesis of benzindene prostaglandins Chirogate International Inc. (TW) 2013-04-03 EP disclosed
EP-0155819-B1 IMPROVEMENTS RELATING TO PESTICIDES BTG INTERNATIONAL LIMITED (GB) 1992-02-05 EP disclosed
US-4696944-A Pesticidal cyclopropane carboxylic acid esters, their compositions and use NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1987-09-29 US disclosed
EP-0155819-A2 Improvements relating to pesticides BTG INTERNATIONAL LIMITED (GB) 1985-09-25 EP disclosed
EP-0065356-B1 A METHOD FOR PURIFICATION OF CYCLOPENTENOLONES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-08-07 EP disclosed
US-4411912-A Insecticidal isovaleric acid esters ZOECON CORPORATION (US) 1983-10-25 US disclosed
US-4376871-A Method for purification of cyclopentenolones SUMITOMO CHEMICAL CO., LIMITED (JP) 1983-03-15 US disclosed
EP-0065356-A1 A method for purification of cyclopentenolones SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-11-24 EP disclosed
EP-0010761-B1 PROCESS FOR PREPARING 4-HYDROXY-2-CYCLOPENTEN-I-ONES, 2-METHYL-2,5-DIMETHOXY-2,5-DIHYDROFURANS AND A PROCESS FOR THEIR PREPARATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-10-13 EP disclosed
US-4327109-A INSECTICIDES SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1982-04-27 US disclosed
US-4282372-A Process for producing cyclopentenolones SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-08-04 US disclosed
US-4243819-A Substituted amino acids ZOECON CORPORATION (US) 1981-01-06 US disclosed
US-4229469-A Insecticidal alkadienylcyclopropanecarboxylates SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1980-10-21 US disclosed
EP-0010761-A1 Process for preparing 4-hydroxy-2-cyclopenten-I-ones, 2-methyl-2,5-dimethoxy-2,5-dihydrofurans and a process for their preparation SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-05-14 EP disclosed
US-3998868-A INSECTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-12-21 US disclosed
US-3954814-A INSECTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-05-04 US disclosed