SCHEMBL11094672

SCHEMBL11094672

Cc1cc(C(C)(C)c2ccc(N3C(=O)C=CC3=O)c(C)c2)ccc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 10/20 0.61
▸ MGLL Q99685 1/20 0.45
▸ ESR2 Q92731 7/20 0.41
▸ AR P10275 3/20 0.41
▸ KLF10 Q13118 1/20 0.39
▸ ALOX15 P16050 1/20 0.37
▸ ALOX12 P18054 1/20 0.37
▸ RORC P51449 1/20 0.36
▸ ESRRG P62508 1/20 0.36
▸ TLR9 Q9NR96 2/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ G6PD P11413 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ CCR6 P51684 1/20 0.36
▸ NPSR1 Q6W5P4 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
SCHEMBL2597018 0.91 MGLL (0.53) ESR1MGLLESR2TLR9TDP1
SCHEMBL21888605 0.84 ESR1 (0.48) ESR1MGLLESR2ARKLF10
SCHEMBL11095584 0.79 MGLL (0.42) ESR1MGLLKLF10ALOX15ALOX12
SCHEMBL35285 0.78 ESR1 (1.00) ESR1ESR2ARKLF10ALOX15
SCHEMBL29360146 0.78 ESR1 (1.00) ESR1ESR2ARKLF10ALOX15
SCHEMBL29350788 0.78 ESR1 (1.00) ESR1ESR2ARKLF10ALOX15
SCHEMBL8735072 0.77 MGLL (0.42) MGLLTLR9TDP1G6PDALDH1A1
SCHEMBL298974 0.76 ESR1 (0.95) ESR1ESR2ARKLF10ALOX15
SCHEMBL29696084 0.76 ESR1 (0.95) ESR1ESR2ARKLF10ALOX15
SCHEMBL30474623 0.75 ESR1 (0.62) ESR1MGLLESR2ALOX12TLR9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0051687-B1 MALEIMIDES AND PROCESS FOR THE PREPARATION OF SAME MITSUI TOATSU CHEMICALS, Inc. (JP) 1984-05-16 — — EP claimed
US-4400521-A RESINS, VARNICHES, CURING AGENTS, LAMINATION, ADHESIVES, HEAT RESISTANCE MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1983-08-23 — — US claimed
EP-0051687-A1 Maleimides and process for the preparation of same MITSUI TOATSU CHEMICALS, Inc. (JP) 1982-05-19 — — EP claimed
EP-0051687-B1 MALEIMIDES AND PROCESS FOR THE PREPARATION OF SAME MITSUI TOATSU CHEMICALS, Inc. (JP) 1984-05-16 — — EP disclosed
US-4400521-A RESINS, VARNICHES, CURING AGENTS, LAMINATION, ADHESIVES, HEAT RESISTANCE MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1983-08-23 — — US disclosed
EP-0051687-A1 Maleimides and process for the preparation of same MITSUI TOATSU CHEMICALS, Inc. (JP) 1982-05-19 — — EP disclosed
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