SCHEMBL9863769

SCHEMBL9863769

CCOP(=O)(Cc1ccon1)OCC

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.36
KDM4E B2RXH2 2/20 0.33
KCNN4 O15554 1/20 0.33
KCNA5 P22460 1/20 0.33
PPARD Q03181 1/20 0.33
ALDH1A1 P00352 1/20 0.33
EGFR P00533 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NPY5R Q15761 1/20 0.32
RAB9A P51151 1/20 0.32
KCNH2 Q12809 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL23713981 0.74 TSHR (0.39) TSHRMAPTHTTKDM4EPPARD
SCHEMBL5010543 0.73 PGK1 (0.52) TSHRMAPTHTTKDM4EPPARD
SCHEMBL9863809 0.71 MAPT (0.42) TSHRMAPTHTTALDH1A1RAB9A
SCHEMBL23714017 0.70 TSHR (0.39) TSHRMAPTHTTKDM4EPPARD
SCHEMBL11397475 0.70 MAPT (0.44) TSHRMAPTHTTPPARDEGFR
SCHEMBL992724 0.69 ALDH1A1 (0.53) KCNA5ALDH1A1NPSR1
SCHEMBL23713988 0.69 TSHR (0.38) TSHRMAPTHTTKDM4EPPARD
SCHEMBL17032485 0.69 KDM4E (0.51) KDM4EALDH1A1NPSR1RAB9AMEN1
SCHEMBL31403483 0.69 TLR8 (0.38) TSHRNPY5R
SCHEMBL5021640 0.69 TSHR (0.34) TSHRMAPTHTTKDM4EPPARD

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-5041567-A Human and veterianary medicine; veneral diseases respiratory diseases, bovine mastitis BEECHAM GROUP PLC (GB) 1991-08-20 US disclosed
US-4812470-A Antibacterial monic acid derivatives BEECHAM GROUP P.L.C. (GB) 1989-03-14 US disclosed
EP-0087953-B1 ANTIBACTERIAL 1-NORMON-2-YL-HETEROCYCLIC COMPOUNDS BEECHAM GROUP PLC (GB) 1988-04-27 EP disclosed
EP-0087953-A2 Antibacterial 1-normon-2-yl-heterocyclic compounds BEECHAM GROUP PLC (GB) 1983-09-07 EP disclosed