SCHEMBL10736364

SCHEMBL10736364

O=C1OC(=O)C(c2ccc(C3=C(c4ccccc4)C(=O)OC3=O)cc2)=C1c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 9/20 0.69
KMT2A Q03164 2/20 0.54
PTGS1 P23219 3/20 0.48
TDP1 Q9NUW8 2/20 0.46
ALOX15 P16050 1/20 0.46
PDE4B Q07343 1/20 0.44
CTRC Q99895 1/20 0.44
ALDH1A1 P00352 3/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.44
HTT P42858 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
MITF O75030 1/20 0.44
HPGD P15428 1/20 0.44
NTSR1 P30989 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ABCB11 O95342 1/20 0.43
MT-CO2 P00403 1/20 0.43
HTR1A P08908 1/20 0.43

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
SCHEMBL592300 0.97 PTGS2 (0.65) PTGS2KMT2APTGS1TDP1ALOX15
SCHEMBL6674116 0.85 PTGS2 (0.55) PTGS2KMT2APTGS1TDP1ALOX15
SCHEMBL10733826 0.85 PTGS2 (0.55) PTGS2MAPT
SCHEMBL14026037 0.83 PTGS2 (0.53) PTGS2KMT2APTGS1TDP1ALDH1A1
SCHEMBL8423806 0.82 PTGS2 (0.69) PTGS2PTGS1ALDH1A1ABCB11MT-CO2
SCHEMBL9665390 0.82 PTGS2 (0.56) PTGS2KMT2APTGS1ALDH1A1LMNA
SCHEMBL10684202 0.80 PTGS2 (0.55) PTGS2KMT2ATDP1ALOX15PDE4B
SCHEMBL4687129 0.80 PTGS2 (0.50) PTGS2KMT2ATDP1ALOX15PDE4B
SCHEMBL28179293 0.80 PTGS2 (0.50) PTGS2KMT2ATDP1ALOX15PDE4B
SCHEMBL27589881 0.80 PTGS2 (0.50) PTGS2KMT2APTGS1TDP1PDE4B

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-4638072-A POLYAMIDES, POLYIMIDES STANDARD OIL COMPANY (INDIANA) (US) 1987-01-20 US disclosed
US-4596867-A Disubstituted maleic anhydride compounds STANDARD OIL COMPANY (INDIANA) (US) 1986-06-24 US disclosed