SCHEMBL5267753

SCHEMBL5267753

O=C(O)c1nc2scc(CBr)c2c(=O)[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 4/20 0.42
ALDH1A1 P00352 5/20 0.38
KMT2A Q03164 4/20 0.38
KDM4E B2RXH2 3/20 0.38
POLB P06746 2/20 0.38
MAPT P10636 2/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
MMP8 P22894 3/20 0.38
MMP13 P45452 3/20 0.38
MMP2 P08253 1/20 0.35
MMP10 P09238 1/20 0.35
CYP1A2 P05177 1/20 0.35
GAA P10253 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35
LMNA P02545 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL8186314 0.86 EGLN1 (0.42) EGLN1ALDH1A1KMT2AKDM4EPOLB
SCHEMBL688951 0.82 ALDH1A1 (0.58) ALDH1A1KMT2AKDM4EPOLBMAPT
SCHEMBL8198011 0.78 HPGD (0.45) EGLN1ALDH1A1KMT2AKDM4EPOLB
SCHEMBL5260896 0.78 EGLN1 (0.56) EGLN1ALDH1A1KMT2AKDM4EPOLB
SCHEMBL5265986 0.77 EGLN1 (0.48) EGLN1ALDH1A1KMT2AKDM4EPOLB
SCHEMBL688025 0.76 EGLN1 (0.44) EGLN1ALDH1A1KMT2AKDM4EPOLB
SCHEMBL13343656 0.74 EGLN1 (0.39) EGLN1ALDH1A1KMT2AKDM4EPOLB
SCHEMBL8196873 0.74 EGLN1 (0.39) EGLN1ALDH1A1KMT2AKDM4EPOLB
SCHEMBL8204571 0.72 KMT2A (0.58) ALDH1A1KMT2AKDM4EPOLBMAPT
SCHEMBL13343699 0.72 ALDH1A1 (0.44) EGLN1ALDH1A1KMT2AKDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1740551-A1 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF AS AN MMP-13 INHIBITOR Takeda Pharmaceutical Company Limited (JP) 2007-01-10 EP disclosed
WO-2005105760-A1 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF AS AN MMP-13 INHIBITOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-11-10 WO disclosed