SCHEMBL20537449

SCHEMBL20537449

[CH2][C@@H]1OC(c2ccccc2)O[C@H]1c1ccccc1[N+](=O)[O-]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNMT3B Q9UBC3 4/20 0.40
KMT2A Q03164 3/20 0.37
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 2/20 0.37
MAPT P10636 2/20 0.37
GAA P10253 1/20 0.37
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 6/20 0.37
TDP1 Q9NUW8 1/20 0.37
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KCNA4 P22459 1/20 0.36
KCNA1 Q09470 1/20 0.36
KCNAB1 Q14722 1/20 0.36
CUL4A Q13619 1/20 0.36
GPR35 Q9HC97 1/20 0.36
GPR68 Q15743 1/20 0.36
POLB P06746 2/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL16795798 1.00 DNMT3B (0.40) DNMT3BKMT2AKDM4EMEN1MAPT
SCHEMBL20537647 1.00 DNMT3B (0.40) DNMT3BKMT2AKDM4EMEN1MAPT
SCHEMBL16796701 0.82 DNMT3B (0.40) DNMT3BKMT2AKDM4EMEN1MAPT
SCHEMBL20537462 0.82 HSD17B10 (0.41) DNMT3BKMT2AKDM4EMEN1MAPT
SCHEMBL20537738 0.82 HSD17B10 (0.41) DNMT3BKMT2AKDM4EMEN1MAPT
SCHEMBL20537519 0.82 HSD17B10 (0.41) DNMT3BKMT2AKDM4EMEN1MAPT
SCHEMBL18802935 0.80 DNMT3B (0.38) DNMT3BKMT2AKDM4EMEN1MAPT
SCHEMBL15551602 0.80 DNMT3B (0.38) DNMT3BKMT2AKDM4EMEN1MAPT
SCHEMBL18186743 0.80 DNMT3B (0.38) DNMT3BKMT2AKDM4EMEN1MAPT
SCHEMBL15550765 0.80 DNMT3B (0.38) DNMT3BKMT2AKDM4EMEN1MAPT

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-3079685-B1 SULFAMATE DERIVATIVE COMPOUNDS FOR USE IN TREATING OR ALLEVIATING PAIN BIO PHARM SOLUTIONS CO LTD (KR) 2018-11-28 EP claimed
EP-3079686-B1 SULFAMATE DERIVATIVE COMPOUND FOR USE IN PREVENTING OR TREATING EPILEPSY BIO PHARM SOLUTIONS CO LTD (KR) 2018-10-24 EP claimed