SCHEMBL7295136

SCHEMBL7295136

CCOC(=O)[C@H]1NCC(=S)C1C(=O)CC1Cc2cc(C)c(OC)cc2C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.38
KMT2A Q03164 5/20 0.38
KDM4E B2RXH2 4/20 0.38
LMNA P02545 2/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
DHFR P00374 1/20 0.33
CYP2C19 P33261 3/20 0.33
MEN1 O00255 3/20 0.33
CYP2C9 P11712 2/20 0.33
CYP3A4 P08684 2/20 0.32
MAPK1 P28482 1/20 0.32
HPGD P15428 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
POLB P06746 2/20 0.32
GAA P10253 2/20 0.32
ALOX15 P16050 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL7302832 0.83 GAA (0.38) ALDH1A1KMT2AKDM4EDHFRCYP2C19
SCHEMBL7296622 0.80 GAA (0.36) ALDH1A1KDM4ELMNADHFRCYP2C19
SCHEMBL7294598 0.79 CYP26A1 (0.44) ALDH1A1KMT2AKDM4ECA1CA2
SCHEMBL7304044 0.78 POLB (0.31) POLB
SCHEMBL7296333 0.77 ADRA1D (0.39) KDM4ECYP2C19CYP2C9MAPK1GAA
SCHEMBL7305086 0.77 ADRA1D (0.39) KDM4ECYP2C19CYP2C9MAPK1GAA
SCHEMBL7302057 0.77 ADRA1D (0.39) KDM4ECYP2C19CYP2C9MAPK1GAA
SCHEMBL7294376 0.74 ALDH1A1 (0.32) ALDH1A1KMT2AKDM4ECYP2C19MEN1
SCHEMBL7301966 0.73 HTR1A (0.34) ALDH1A1KDM4ECYP2C19CYP3A4MAPK1
SCHEMBL7295766 0.71 ADRA1D (0.34) ALDH1A1KDM4ECYP2C19CYP2C9HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0372484-B1 Condensed benzene derivative ZERIA PHARM CO LTD (JP) 1994-10-26 EP disclosed
US-5028604-A Cognition Activators ZERIA PHARMACEUTICAL CO., LTD. (JP) 1991-07-02 US disclosed
EP-0372484-A2 Condensed benzene derivative ZERIA PHARMACEUTICAL CO., LTD. (JP) 1990-06-13 EP disclosed