SCHEMBL17326506

SCHEMBL17326506

CC(=O)Nc1cccc(Oc2ccc3c(c2)C(=O)N(c2cccc(C)c2)C3=O)c1

nearest known ligand 0.75

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.75
▸ HSD17B10 Q99714 3/20 0.61
▸ HPGD P15428 2/20 0.61
▸ ALDH1A1 P00352 5/20 0.57
▸ POLB P06746 4/20 0.57
▸ BRD4 O60885 1/20 0.51
▸ MEN1 O00255 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ MAPT P10636 1/20 0.49
▸ PKM P14618 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ SCN2A Q99250 1/20 0.46

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 0.90 HPGD (0.68) MAPK1HSD17B10HPGDALDH1A1POLB
SCHEMBL17326498 0.87 POLB (0.67) MAPK1HSD17B10HPGDALDH1A1POLB
SCHEMBL14947001 0.84 MAPK1 (0.81) MAPK1HSD17B10HPGDALDH1A1POLB
SCHEMBL17326730 0.83 HPGD (0.62) MAPK1HSD17B10HPGDALDH1A1POLB
SCHEMBL13899508 0.82 MEN1 (0.59) MAPK1HPGDALDH1A1POLBBRD4
SCHEMBL17326722 0.81 CYP2C9 (0.60) MAPK1HSD17B10HPGDALDH1A1POLB
SCHEMBL14384855 0.79 HSD17B10 (0.72) MAPK1HSD17B10ALDH1A1MEN1KMT2A
SCHEMBL14010049 0.79 BRD4 (0.56) MAPK1HSD17B10HPGDALDH1A1POLB
SCHEMBL16917060 0.78 HSD17B10 (0.57) MAPK1HSD17B10HPGDALDH1A1POLB
SCHEMBL14384846 0.78 MTNR1A (0.64) MAPK1HSD17B10HPGDALDH1A1POLB

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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