SCHEMBL21449843

SCHEMBL21449843

O=C(OCCCN1C(=O)c2cccc3cccc(c23)C1=O)c1ccc2nc(C3C(=O)c4ccccc4C3=O)ccc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.45
▸ PDE10A Q9Y233 1/20 0.44
▸ ALDH1A1 P00352 5/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ MAPK1 P28482 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ HEXA P06865 2/20 0.42
▸ HEXB P07686 2/20 0.42
▸ DRD3 P35462 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.41
▸ LPAR2 Q9HBW0 1/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ POLB P06746 3/20 0.41

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
SCHEMBL21449859 0.94 PDE10A (0.48) RXFP1PDE10AALDH1A1SMN1; SMN2MAPK1
SCHEMBL21449819 0.94 MAPK1 (0.47) ALDH1A1SMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL21449840 0.90 LPAR2 (0.42) RXFP1PDE10AALDH1A1SMN1; SMN2MAPK1
SCHEMBL21449876 0.89 ALDH1A1 (0.42) RXFP1PDE10AALDH1A1SMN1; SMN2MAPK1
SCHEMBL21449809 0.89 MAPK1 (0.43) ALDH1A1SMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL21449825 0.89 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL21449871 0.88 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL21449815 0.88 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL21449811 0.87 MAPK1 (0.41) RXFP1ALDH1A1SMN1; SMN2MAPK1MEN1
SCHEMBL21449823 0.86 MAPK1 (0.43) RXFP1ALDH1A1SMN1; SMN2MAPK1MEN1

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-2019194381-A1 QUINOPHTHALONE-BASED COMPOUND, PHOTOSENSITIVE RESIN COMPOSITION COMPRISING SAME, PHOTOSENSITIVE MATERIAL, COLOR FILTER, AND DISPLAY DEVICE 주식회사 엘지화학 2019-10-10 — — WO disclosed
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