SCHEMBL8289303

SCHEMBL8289303

CCOC(=O)c1c(B2OC(C)(C)C(C)(C)O2)c(N)c(CC)n1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 1/20 0.40
MAPT P10636 3/20 0.37
KMT2A Q03164 1/20 0.37
POLB P06746 1/20 0.35
KDM4E B2RXH2 5/20 0.33
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 2/20 0.33
LMNA P02545 1/20 0.33
MAOA P21397 1/20 0.33
HPGD P15428 6/20 0.33
ALDH1A1 P00352 5/20 0.33
HSD17B10 Q99714 3/20 0.33
USP2 O75604 1/20 0.33
GAA P10253 3/20 0.32
MAPK1 P28482 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL4373375 0.82 UCHL1 (0.41) UCHL1KMT2AKDM4EALDH1A1MAPK1
SCHEMBL14115033 0.69 UCHL1 (0.40) UCHL1KMT2ACYP1A2CYP3A4LMNA
SCHEMBL4811790 0.69 CA12 (0.47) UCHL1MAPTKMT2ACYP1A2CYP3A4
SCHEMBL4386058 0.69 GRIA2 (0.53) UCHL1
SCHEMBL18125046 0.68 UCHL1 (0.41) UCHL1MAPTKMT2AKDM4ECYP1A2
SCHEMBL14115035 0.68 UCHL1 (0.41) UCHL1KMT2AKDM4ECYP1A2CYP3A4
SCHEMBL15570368 0.67 CA12 (0.45) UCHL1MAPTKMT2AKDM4ECYP1A2
SCHEMBL4378867 0.67 ALDH1A1 (0.52) MAPTKMT2APOLBKDM4EALDH1A1
SCHEMBL1492360 0.67 UCHL1 (0.42) UCHL1MAPTKDM4ECYP1A2CYP3A4
SCHEMBL16830896 0.67 UCHL1 (0.38) UCHL1KMT2AKDM4EHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005040110-A1 PYRROLE AND PYRAZOLE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2005-05-06 WO disclosed