SCHEMBL6574339

SCHEMBL6574339

O=C(O)c1cccc([C@H](O)CBr)n1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.53
ALOX15 P16050 2/20 0.53
TSHR P16473 2/20 0.53
ACMSD Q8TDX5 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
LMNA P02545 3/20 0.40
GNE Q9Y223 1/20 0.39
KMT2A Q03164 2/20 0.38
MRGPRX4 Q96LA9 2/20 0.37
MGAM O43451 1/20 0.37
ECE1 P42892 1/20 0.36
NAPRT Q6XQN6 1/20 0.36
P4HTM Q9NXG6 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CES1 P23141 1/20 0.34
HIF1A Q16665 1/20 0.34
MEN1 O00255 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
SCHEMBL6578020 0.83 KDM4E (0.53) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL22931517 0.80 KDM4E (0.64) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL7419647 0.78 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL16845797 0.77 KDM4E (0.59) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL22481292 0.75 ADRB1 (0.60) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL21009276 0.75 KDM4E (0.52) KDM4EALOX15TSHRACMSDTDP1
Dipicolinic Acid SCHEMBL29094219 0.74 KDM4E (0.94) KDM4EALOX15TSHRACMSDTDP1
Dipicolinic Acid SCHEMBL29094220 0.74 KDM4E (0.94) KDM4EALOX15TSHRACMSDTDP1
Dipicolinic Acid SCHEMBL6561776 0.74 KDM4E (0.94) KDM4EALOX15TSHRACMSDTDP1
Dipicolinic Acid SCHEMBL9491853 0.74 KDM4E (0.94) KDM4EALOX15TSHRACMSDTDP1

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
US-20040265991-A1 Process for preparation of (s)-alpha-halomethylpyridine-methanol derivatives KANEKA CORPORATION (JP) 2004-12-30 US disclosed
EP-1454899-A1 PROCESS FOR PREPARATION OF (S)-ALPHA-HALOME THYLPYRIDINE METHANOL DERIVATIVES KANEKA CORPORATION (JP) 2004-09-08 EP disclosed