SCHEMBL88004

SCHEMBL88004

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

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.54
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
DPP4 P27487 2/20 0.35
LMNA P02545 4/20 0.35
MAPT P10636 1/20 0.33
HPGD P15428 2/20 0.33
ALOX12 P18054 1/20 0.33
CCR6 P51684 1/20 0.33
CYP1A2 P05177 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL569156 0.79 ALDH1A1 (0.56) ALDH1A1POLBSMN1; SMN2DPP4LMNA
SCHEMBL13786 0.79 ALDH1A1 (0.56) ALDH1A1POLBSMN1; SMN2DPP4LMNA
SCHEMBL88005 0.77 ALDH1A1 (0.54) ALDH1A1POLBSMN1; SMN2DPP4LMNA
SCHEMBL3258454 0.77 ALDH1A1 (0.54) ALDH1A1POLBSMN1; SMN2DPP4LMNA
SCHEMBL2159389 0.76 ZDHHC20 (0.46) ALDH1A1HPGD
SCHEMBL8845450 0.74 ALDH1A1 (0.52) ALDH1A1POLBSMN1; SMN2DPP4LMNA
SCHEMBL49389 0.74 ALDH1A1 (0.52) ALDH1A1POLBSMN1; SMN2DPP4LMNA
SCHEMBL692534 0.74 ALDH1A1 (0.52) ALDH1A1POLBSMN1; SMN2DPP4LMNA
SCHEMBL7156751 0.74 ALDH1A1 (0.52) ALDH1A1POLBSMN1; SMN2DPP4LMNA
SCHEMBL11616346 0.74 ALDH1A1 (0.52) ALDH1A1POLBSMN1; SMN2DPP4LMNA

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

Appears in 2111 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3816153-B1 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2023-10-18 EP claimed
EP-3953340-B1 NOVEL OXADIAZOLE COMPOUNDS FOR CONTROLLING OR PREVENTING PHYTOPATHOGENIC FUNGI PI INDUSTRIES LTD (IN) 2023-08-02 EP claimed
EP-3953341-B1 NOVEL OXADIAZOLE COMPOUNDS FOR CONTROLLING OR PREVENTING PHYTOPATHOGENIC FUNGI PI INDUSTRIES LTD (IN) 2023-07-26 EP claimed
US-20220106349-A1 Compounds EPIENDO PHARMACEUTICALS EHF (IS) 2022-04-07 US claimed
US-11236120-B2 Azithromycin derivatives with epithelial barrier enhancement properties EPIENDO PHARMACEUTICALS EHF (IS) 2022-02-01 US claimed
EP-2772480-B2 HIV REPLICATION INHIBITOR SHIONOGI & CO (JP) 2020-12-09 EP claimed
CN-111936485-A Novel anthranilamides, their use as pesticides and process for their preparation PI工业有限公司 2020-11-13 CN claimed
US-20200317710-A1 Azithromycin Derivatives With Epithelial Barrier Enhancement Properties EPIENDO PHARMACEUTICALS EHF (IS) 2020-10-08 US claimed
EP-3708573-A1 AZITHROMYCIN DERIVATIVES WITH EPITHELIAL BARRIER ENHANCEMENT PROPERTIES EpiEndo Pharmaceuticals ehf. (IS) 2020-09-16 EP claimed
US-10676449-B2 Electronically activated strained alkynes WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2020-06-09 US claimed
EP-0053902-A1 Phosphinylalkanoyl substituted prolines E.R. Squibb & Sons, Inc. (US) 1982-06-16 EP claimed
EP-0050321-A2 Novel bicyclooxyphenyl ureas, process for their preparation and pesticides containing them UNION CARBIDE CORPORATION (US) 1982-04-28 EP claimed
US-4316932-A Combating fungi with α-azolyl-keto derivatives BAYER AKTIENGESELLSCHAFT (DE) 1982-02-23 US claimed
US-4312809-A ANGIOTENSIN CONVERTING ENZYME INHIBITORS, HYPOTENSIVE E. R. SQUIBB & SONS, INC. (US) 1982-01-26 US claimed
EP-0005249-B1 SUBSTITUTED ALKANYL-AZOLYL CARBAMATES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS INSECTICIDES, ACARICIDES AND NEMATOCIDES BAYER AG (DE) 1981-09-02 EP claimed
US-4263037-A 5-Cyano-2,3-dihydrobenzofurans useful as herbicides FISONS LIMITED (GB) 1981-04-21 US claimed
US-4112080-A INSECTICIDE, MITICIDE, NEMATOCIDE BAYER AKTIENGESELLSCHAFT (DE) 1978-09-05 US claimed
US-4085098-A Azo dyes containing a heterocyclic ring having a quaternized nitrogen atom and at least one optionally substituted phenoxyalkyl or naphthyloxyalkyl substituent SANDOZ LTD. (CH) 1978-04-18 US claimed
US-3980632-A SYNTHETIC MATERIALS, LEATHER, PAPER, PIGMENTING PLASTICS SANDOZ LTD. (CH) 1976-09-14 US claimed
US-3951978-A ANALGESIC, ANTIARRHYTHMIC, CENTRAL NERVOUS DEPRESSANT ISTITUTO LUSO FARMACO D'ITALIA S.R.L. (IT) 1976-04-20 US claimed