SCHEMBL17326730

SCHEMBL17326730

CCOc1ccc(N2C(=O)c3ccc(Oc4cccc(NC(C)=O)c4)cc3C2=O)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.62
▸ HSD17B10 Q99714 1/20 0.62
▸ ALDH1A1 P00352 3/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ POLB P06746 2/20 0.55
▸ BRD4 O60885 1/20 0.55
▸ MAPK1 P28482 1/20 0.51
▸ MEN1 O00255 5/20 0.51
▸ KMT2A Q03164 5/20 0.51
▸ PKM P14618 1/20 0.50
▸ SCN2A Q99250 1/20 0.50
▸ LMNA P02545 1/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ HTT P42858 1/20 0.47
▸ MAPT P10636 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ RPS6KA2 Q15349 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45

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
SCHEMBL17326282 0.88 HPGD (0.68) HPGDHSD17B10ALDH1A1NPSR1POLB
SCHEMBL17326722 0.84 CYP2C9 (0.60) HPGDHSD17B10ALDH1A1NPSR1POLB
SCHEMBL17326506 0.83 MAPK1 (0.75) HPGDHSD17B10ALDH1A1NPSR1POLB
SCHEMBL17326498 0.81 POLB (0.67) HPGDHSD17B10ALDH1A1POLBBRD4
SCHEMBL10264545 0.76 SMN1; SMN2 (0.67) HSD17B10POLBMEN1KMT2ALMNA
SCHEMBL10593088 0.74 HPGD (0.60) HPGDHSD17B10ALDH1A1NPSR1MAPK1
SCHEMBL17326261 0.73 LMNA (0.55) ALDH1A1POLBMAPK1MEN1KMT2A
SCHEMBL17326661 0.73 KMT2A (0.60) HPGDHSD17B10ALDH1A1NPSR1POLB
SCHEMBL11862277 0.72 KDM4E (0.74) HPGDHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL14338249 0.72 MTNR1B (0.69) HPGDHSD17B10ALDH1A1POLBMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015185785-A1 DERIVATIVES OF ISOINDOLIN-1,3-DIONE CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (CSIC) (ES) 2015-12-10 — — WO disclosed
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