SCHEMBL28016536

SCHEMBL28016536

CCCCC(=O)Oc1ccccc1CN

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
KDM4E B2RXH2 1/20 0.61
RECQL P46063 1/20 0.61
POLM Q9NP87 2/20 0.46
POLK Q9UBT6 2/20 0.46
POLL Q9UGP5 2/20 0.46
POLH Q9Y253 2/20 0.46
THRA P10827 1/20 0.46
THRB P10828 1/20 0.46
ALOX15 P16050 1/20 0.43
PPARG P37231 2/20 0.42
PPARA Q07869 1/20 0.42
PTGS2 P35354 1/20 0.40
NR1I2 O75469 1/20 0.40
LMNA P02545 1/20 0.40
CHRM2 P08172 1/20 0.40
CYP3A4 P08684 1/20 0.40
ADRA2A P08913 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL27491120 0.90 KDM4E (0.49) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL3505902 0.89 KDM4E (0.67) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL27365378 0.87 KMT2A (0.42) MEN1KMT2AKDM4ERECQLTHRA
SCHEMBL27659872 0.86 KDM4E (0.63) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL28969837 0.86 KDM4E (0.63) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL16756230 0.85 KDM4E (0.75) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL11456688 0.84 KDM4E (0.61) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL9275434 0.84 KDM4E (0.60) MEN1KMT2AKDM4ERECQLPOLM
SCHEMBL28024055 0.83 ELANE (0.44) MEN1KMT2AKDM4ERECQLTHRA
SCHEMBL31396225 0.83 KDM4E (0.59) MEN1KMT2AKDM4ERECQLPOLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104884442-B Terazololine-one compound and application thereof 住友化学株式会社 2016-11-02 CN disclosed
CN-104684908-B Terazololine-one compound and the purposes as insecticide thereof 住友化学株式会社 2016-09-28 CN disclosed
CN-104884442-A Tetrazolinone compound and applications thereof SUMITOMO CHEMICAL CO 2015-09-02 CN disclosed
CN-104684908-A Tetrazolinone compounds and their use as pesticides SUMITOMO CHEMICAL CO 2015-06-03 CN disclosed