SCHEMBL289811

SCHEMBL289811

CN(C)CC(=C=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.50
ALDH1A1 P00352 4/20 0.48
HIF1A Q16665 1/20 0.48
KDM4E B2RXH2 1/20 0.46
USP2 O75604 1/20 0.46
KMT2A Q03164 2/20 0.40
RAB9A P51151 3/20 0.40
MAPT P10636 2/20 0.40
NPC1 O15118 2/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
ATM Q13315 1/20 0.40
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
HPGD P15428 2/20 0.38
HSP90AA1 P07900 1/20 0.36

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
SCHEMBL5185723 0.81 MAOA (0.41) ALDH1A1KDM4EUSP2KMT2ARAB9A
SCHEMBL5774143 0.81 HTT (0.40) ALDH1A1HIF1AKDM4EKMT2AHTT
SCHEMBL3411071 0.81 BCL2L1 (0.42) ALDH1A1MAPTNPC1MAOAMAOB
SCHEMBL5489563 0.79 HPGD (0.45) ALDH1A1KDM4EMAPTHTTMAOA
SCHEMBL847542 0.79 ALDH1A1 (0.44) ALDH1A1HIF1AKDM4EHTT
SCHEMBL5200753 0.79 PARP1 (0.43) ALDH1A1KDM4EKMT2ARAB9AMAPT
SCHEMBL5777797 0.79 PBRM1 (0.42) EGFRALDH1A1HIF1AKDM4EKMT2A
SCHEMBL5779117 0.79 MEP1B (0.41) HIF1AKMT2AMAOAMAOB
SCHEMBL290340 0.78 CES2 (0.46) ALDH1A1KMT2AMAPTHTTMAOA
SCHEMBL5776042 0.78 NOS1 (0.42) ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2427057-A1 BENZOFURAN-4,5-DIONES AS SELECTIVE PEPTIDE DEFORMYLASE INHIBITORS Sloan-Kettering Institute for Cancer Research (US) 2012-03-14 EP disclosed
WO-2010129049-A1 BENZOFURAN-4,5-DIONES AS SELECTIVE PEPTIDE DEFORMYLASE INHIBITORS SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2010-11-11 WO disclosed
WO-2007001335-A2 RAMOPLANIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-01-04 WO disclosed
US-5710157-A INSECTICIDES FOR AGRICULTURE FMC CORPORATION (US) 1998-01-20 US disclosed
US-5593998-A 2,4-diamino-5,6-disubstituted-and 5,6,7-trisubstituted-5-deazapteridines as insecticides FMC CORPORATION (US) 1997-01-14 US disclosed
US-5547954-A MIXED WITH AGRICULTURAL ACCEPTABLE CARRIER FMC CORPORATION (US) 1996-08-20 US disclosed
US-5532370-A FOR INSECTS INCLUDING LARVAE SUCH AS TOBACCO BUDWORM FMC CORPORATION (US) 1996-07-02 US disclosed