SCHEMBL569860

SCHEMBL569860

C=CCN(CC=C)C([NH])=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
SMN1; SMN2 Q16637 3/20 0.38
DPP4 P27487 2/20 0.38
POLB P06746 1/20 0.35
LMNA P02545 4/20 0.33
MAPT P10636 1/20 0.33
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
HPGD P15428 2/20 0.32
ALOX12 P18054 1/20 0.32
CCR6 P51684 1/20 0.32
CYP1A2 P05177 1/20 0.31
NPSR1 Q6W5P4 1/20 0.30
KDM4E B2RXH2 1/20 0.30
HTT P42858 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
SCHEMBL3259264 0.77 ZDHHC20 (0.45) ALDH1A1
SCHEMBL569156 0.77 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2DPP4POLBLMNA
SCHEMBL13786 0.77 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2DPP4POLBLMNA
SCHEMBL3258454 0.74 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2DPP4POLBLMNA
SCHEMBL88005 0.74 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2DPP4POLBLMNA
SCHEMBL88004 0.74 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2DPP4POLBLMNA
SCHEMBL12505249 0.74 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2DPP4POLBLMNA
SCHEMBL18496092 0.74 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2DPP4POLBLMNA
SCHEMBL692534 0.72 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2DPP4POLBLMNA
SCHEMBL8985064 0.72 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2DPP4POLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3169662-B1 SUBSTITUTED VINYL- AND ALKINYL-CYANOCYCLOALKANOLS AND VINYL- AND ALKINYL-CYANOHETEROCYCLOALKANOLS AS AGENTS TO COMBAT ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2018-07-11 EP claimed
EP-3169662-A1 SUBSTITUTED VINYL AND ALKYNYL CYANOCYCLOALKANOLS AND VINYL AND ALKYNYL CYANOHETEROCYCLOALKANOLS AS ACTIVE AGENTS AGAINST ABIOTIC PLANT STRESS Bayer CropScience Aktiengesellschaft (DE) 2017-05-24 EP claimed
WO-2016008862-A1 SUBSTITUTED VINYL AND ALKYNYL CYANOCYCLOALKANOLS AND VINYL AND ALKYNYL CYANOHETEROCYCLOALKANOLS AS ACTIVE AGENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-01-21 WO claimed
EP-2928297-A1 USE OF SUBSTITUTED 1-(ARYL ETHYNYL)-, 1-(HETEROARYL ETHYNYL)-, 1-(HETEROCYCLYL ETHYNYL)- AND 1-(CYLOALKENYL ETHYNYL)-BICYCLOALKANOLS AS ACTIVE AGENTS AGAINST ABIOTIC PLANT STRESS Bayer CropScience AG (DE) 2015-10-14 EP claimed
EP-2928296-A1 USE OF SUBSTITUTED 1-(ARYL ETHYNYL)-, 1-(HETEROARYL ETHYNYL)-, 1-(HETEROCYCLYL ETHYNYL)- AND 1-(CYLOALKENYL ETHYNYL)-CYCLOHEXANOLS AS ACTIVE AGENTS AGAINST ABIOTIC PLANT STRESS Bayer CropScience AG (DE) 2015-10-14 EP claimed
US-8921380-B2 Pyrazolo[1,5-a] pyrimidine compounds as CB1 receptor antagonist MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-12-30 US claimed
WO-2014179144-A1 FUNGICIDAL HETEROCYCLIC COMPOUNDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2014-11-06 WO claimed
WO-2014086751-A1 USE OF SUBSTITUTED 1-(ARYL ETHYNYL)-, 1-(HETEROARYL ETHYNYL)-, 1-(HETEROCYCLYL ETHYNYL)- AND 1-(CYLOALKENYL ETHYNYL)-CYCLOHEXANOLS AS ACTIVE AGENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2014-06-12 WO claimed
WO-2014086723-A1 USE OF SUBSTITUTED 1-(ARYL ETHYNYL)-, 1-(HETEROARYL ETHYNYL)-, 1-(HETEROCYCLYL ETHYNYL)- AND 1-(CYLOALKENYL ETHYNYL)-BICYCLOALKANOLS AS ACTIVE AGENTS AGAINST ABIOTIC PLANT STRESS BAYER CROPSCIENCE AG (DE) 2014-06-12 WO claimed
EP-2697214-A1 SUBSTITUTED VINYL AND ALKINYL CYCLOHEXENOLS AS ACTIVE AGENTS AGAINST ABIOTIC STRESS IN PLANTS Bayer Intellectual Property GmbH (DE) 2014-02-19 EP claimed
CN-1045710-C Pesticidal 1-arylimidazoles RHONE POULENC AGROCHIMIE (FR) 1999-10-20 CN claimed
WO-1999032494-A1 FUSED 1,2,4-THIADIAZINE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1999-07-01 WO claimed
CN-1208036-A Pesticidal 1-(2-pyridyl) pyrazoles RHONE POULENC AGROCHIMIE (FR) 1999-02-17 CN claimed
CN-1041269-C 1- (2-pyridyl) pyrazole insecticidal composition RHONE POULENC AGROCHIMIE (FR) 1998-12-23 CN claimed
EP-0436199-B1 Cyclopropyl derivative lipoxygenase inhibitors ABBOTT LAB (US) 1994-08-03 EP claimed
CN-1063283-A 1- (2-pyridyl) pyrazole pesticide RHONE POULENC AGROCHIMIE (FR) 1992-08-05 CN claimed
EP-0436199-A1 Cyclopropyl derivative lipoxygenase inhibitors ABBOTT LABORATORIES (US) 1991-07-10 EP claimed
CN-1046898-A 1-Aryimidazole insecticides RHONE POULENC AGROCHIMIE (FR) 1990-11-14 CN claimed
EP-0241826-A1 3-Amino-2-cyano-acrylic acid esters BAYER AG (DE) 1987-10-21 EP claimed
EP-0075117-B1 2H-1,2,4,6-THIATRIAZINE-1,1-DIOXIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES BASF Aktiengesellschaft (DE) 1985-03-13 EP claimed