SCHEMBL7805490

SCHEMBL7805490

COc1ccc(COc2cc(Cl)nc3ccccc23)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.53
MAPT P10636 4/20 0.49
ALDH1A1 P00352 3/20 0.49
LMNA P02545 3/20 0.49
KDM4E B2RXH2 2/20 0.49
HPGD P15428 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MEN1 O00255 1/20 0.49
GAA P10253 1/20 0.49
HTT P42858 2/20 0.49
ABCB1 P08183 1/20 0.48
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47
CSF1R P07333 2/20 0.47
CNR1 P21554 2/20 0.46
CNR2 P34972 2/20 0.46
POLB P06746 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL6805983 0.88 SMN1; SMN2 (0.50) KMT2AMAPTALDH1A1LMNAKDM4E
SCHEMBL26607243 0.87 SMN1; SMN2 (0.51) MAPTLMNAKDM4ESMN1; SMN2HTT
SCHEMBL26616036 0.87 EGFR (0.53) KMT2AMAPTALDH1A1LMNAKDM4E
SCHEMBL30573127 0.84 KMT2A (0.44) KMT2AMAPTALDH1A1LMNAKDM4E
SCHEMBL26607149 0.84 KMT2A (0.44) KMT2AMAPTALDH1A1LMNAKDM4E
SCHEMBL31425607 0.82 AGTR1 (0.49) KMT2AMAPTALDH1A1LMNAKDM4E
SCHEMBL31389252 0.81 ALOX15 (0.65) KMT2AMAPTALDH1A1LMNAKDM4E
SCHEMBL26731735 0.81 MAPT (0.48) KMT2AMAPTALDH1A1LMNAKDM4E
SCHEMBL30572961 0.81 KDM4E (0.42) KMT2AMAPTALDH1A1LMNAKDM4E
SCHEMBL26607414 0.81 KDM4E (0.42) KMT2AMAPTALDH1A1LMNAKDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6320051-B1 AMINO(NH) OR OXYGEN(O) SUBSTITUTED, ENZYME INHIBITORS OF STAPHLOCCOCUS AUREUS METHIONYL T-RNA SYNTHETASE (MRS); ANTIBACTERIAL AGENTS SMITHKLINE BEECHAM PLC (GB) 2001-11-20 US disclosed
EP-1084110-A1 QUINOLONES USED AS MRS INHIBITORS AND BACTERICIDES SMITHKLINE BEECHAM PLC (GB) 2001-03-21 EP disclosed
WO-1999055677-A1 QUINOLONES USED AS MRS INHIBITORS AND BACTERICIDES SMITHKLINE BEECHAM PLC (GB) 1999-11-04 WO disclosed