SCHEMBL9803904

SCHEMBL9803904

O=C1NC(=O)C(=Cc2ccc(OCCCOc3nc4ccccc4o3)cc2)S1

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 8/20 0.58
▸ CISD1 Q9NZ45 3/20 0.58
▸ PPARG P37231 4/20 0.56
▸ PIM1 P11309 2/20 0.55
▸ PIM2 Q9P1W9 2/20 0.55
▸ PTPN1 P18031 1/20 0.53
▸ POLB P06746 1/20 0.53
▸ MAOA P21397 1/20 0.53
▸ MAOB P27338 1/20 0.53
▸ HRH3 Q9Y5N1 1/20 0.51

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
SCHEMBL1848112 0.83 PPARG (0.61) HPGDCISD1PPARGPIM1PIM2
SCHEMBL12521873 0.83 PPARG (0.61) HPGDCISD1PPARGPIM1PIM2
SCHEMBL1848111 0.83 PPARG (0.61) HPGDCISD1PPARGPIM1PIM2
SCHEMBL1849761 0.83 PPARG (0.66) HPGDCISD1PPARGPIM1PIM2
SCHEMBL12521715 0.83 PPARG (0.66) HPGDCISD1PPARGPIM1PIM2
SCHEMBL1849759 0.83 PPARG (0.66) HPGDCISD1PPARGPIM1PIM2
SCHEMBL1851183 0.82 PPARG (0.61) HPGDCISD1PPARGPIM1PIM2
SCHEMBL12521883 0.82 PPARG (0.61) HPGDCISD1PPARGPIM1PIM2
SCHEMBL1851182 0.82 PPARG (0.61) HPGDCISD1PPARGPIM1PIM2
SCHEMBL1848738 0.82 PPARG (0.68) HPGDPPARGPIM1PIM2

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-5075300-A Hypoglycemic and antilipemic agents BEECHAM GROUP P.L.C. (GB) 1991-12-24 — — US claimed
US-5075300-A Hypoglycemic and antilipemic agents BEECHAM GROUP P.L.C. (GB) 1991-12-24 — — US disclosed
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