SCHEMBL7419647

SCHEMBL7419647

O=C(O)c1cccc(C(Br)Br)n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.61
ALOX15 P16050 2/20 0.61
TSHR P16473 1/20 0.61
ACMSD Q8TDX5 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
LMNA P02545 3/20 0.44
GNE Q9Y223 1/20 0.43
KMT2A Q03164 2/20 0.42
MGAM O43451 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
P4HTM Q9NXG6 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ECE1 P42892 1/20 0.40
MEN1 O00255 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
GSK3B P49841 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
SCHEMBL28851121 0.82 KDM4E (0.53) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL22931517 0.82 KDM4E (0.64) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL21009276 0.80 KDM4E (0.52) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL29375171 0.80 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL100967 0.80 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL24581326 0.80 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL6122425 0.80 KDM4E (0.61) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL136738 0.78 KDM4E (0.59) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL16845797 0.78 KDM4E (0.59) KDM4EALOX15TSHRACMSDTDP1
SCHEMBL6574339 0.78 KDM4E (0.53) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5849693-A Cyclic compounds linked by a heterocyclic ring useful as inhibitors of platelet glycoprotein IIb/IIIa THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) 1998-12-15 US disclosed
US-5773411-A CARDIOVASCULAR DISORDERS AND BRAIN DISORDERS AND COAGULANTS THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) 1998-06-30 US disclosed
EP-0672059-A1 CYCLIC COMPOUNDS LINKED BY A HETEROCYCLIC RING USEFUL AS INHIBITORS OF PLATELET GLYCOPROTEIN IIb/IIIa THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1995-09-20 EP disclosed
WO-1994011398-A1 CYCLIC COMPOUNDS LINKED BY A HETEROCYCLIC RING USEFUL AS INHIBITORS OF PLATELET GLYCOPROTEIN IIb/IIIa THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-05-26 WO disclosed