SCHEMBL6578020

SCHEMBL6578020

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

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.53
ALOX15 P16050 1/20 0.53
TSHR P16473 1/20 0.53
ACMSD Q8TDX5 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
MRGPRX4 Q96LA9 3/20 0.40
LMNA P02545 2/20 0.40
GNE Q9Y223 1/20 0.39
KMT2A Q03164 1/20 0.38
MGAM O43451 1/20 0.37
ECE1 P42892 1/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
NAPRT Q6XQN6 1/20 0.36
P4HTM Q9NXG6 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL6574339 0.83 KDM4E (0.53) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL22931517 0.80 KDM4E (0.64) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL16845797 0.77 KDM4E (0.59) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL22481292 0.75 ADRB1 (0.60) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL24581326 0.74 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL7419647 0.74 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL8766369 0.74 L3MBTL1 (0.41) TSHRL3MBTL1
SCHEMBL6122425 0.74 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL100967 0.74 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL29375171 0.74 KDM4E (0.61) 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