SCHEMBL3365965

SCHEMBL3365965

O=C(O)c1ccnc(-c2ncccc2O)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.46
LMNA P02545 3/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.46
TDP1 Q9NUW8 2/20 0.44
KDM3A Q9Y4C1 3/20 0.42
KDM5A P29375 2/20 0.42
JMJD1C Q15652 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
NAPRT Q6XQN6 1/20 0.42
P4HTM Q9NXG6 1/20 0.42
TSHR P16473 2/20 0.41
ALOX15 P16050 1/20 0.41
ACMSD Q8TDX5 1/20 0.41
ALDH1A1 P00352 5/20 0.41
ALOX12 P18054 1/20 0.41
EGLN1 Q9GZT9 4/20 0.40
KDM4A O75164 3/20 0.40
KDM6B O15054 2/20 0.40
TET3 O43151 2/20 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
SCHEMBL1505808 0.78 KDM4E (0.57) KDM4ELMNAKMT2AMEN1TDP1
SCHEMBL3369832 0.75 KDM4E (0.50) KDM4ELMNAKMT2AMEN1TDP1
SCHEMBL696116 0.74 XDH (0.50) KDM4ELMNAKMT2AMEN1TDP1
SCHEMBL3371440 0.73 KDM4E (0.40) KDM4ELMNATDP1L3MBTL1TSHR
Hydrochloric Acid SCHEMBL7968706 0.73 XDH (0.49) KDM4ELMNAKMT2AMEN1TDP1
SCHEMBL9823339 0.72 EGLN1 (0.53) KDM4ELMNATDP1L3MBTL1NAPRT
SCHEMBL6873637 0.71 KDM4E (0.56) KDM4ELMNAKMT2AMEN1TDP1
SCHEMBL3368447 0.71 KDM4C (0.61) KDM4EKDM3AKDM5AALDH1A1EGLN1
SCHEMBL2162964 0.71 CYP1A2 (0.57) KDM4ELMNAKMT2ATDP1ALOX15
SCHEMBL22815116 0.70 KDM4E (0.48) KDM4ELMNAKMT2AMEN1TDP1

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
WO-2010018458-A2 PHENOL DERIVATIVES AND METHODS OF USE THEREOF CRYSTALGENOMICS, INC. (KR) 2010-02-18 WO claimed
WO-2010018458-A2 PHENOL DERIVATIVES AND METHODS OF USE THEREOF CRYSTALGENOMICS, INC. (KR) 2010-02-18 WO disclosed