SCHEMBL21449880

SCHEMBL21449880

O=C(O)c1ccc2nc(C3C(=O)c4ccccc4C3=O)ccc2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.61
▸ KMT2A Q03164 4/20 0.61
▸ ALDH1A1 P00352 4/20 0.61
▸ MAPT P10636 4/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.61
▸ NPC1 O15118 3/20 0.61
▸ MEN1 O00255 2/20 0.61
▸ TP53 P04637 2/20 0.61
▸ CYP3A4 P08684 2/20 0.61
▸ MAPK1 P28482 2/20 0.61
▸ HIF1A Q16665 1/20 0.61
▸ ESR1 P03372 1/20 0.55
▸ HTT P42858 2/20 0.47
▸ PKM P14618 1/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.47
▸ TTR P02766 1/20 0.43
▸ KDM4E B2RXH2 3/20 0.42
▸ HPGD P15428 2/20 0.42
▸ GAA P10253 1/20 0.42
▸ PTPRC P08575 2/20 0.42

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
SCHEMBL13356685 0.86 KMT2A (0.67) RAB9AKMT2AALDH1A1MAPTSMN1; SMN2
Bicarbonate SCHEMBL7756326 0.81 RAB9A (0.87) RAB9AKMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL21449825 0.80 ALDH1A1 (0.46) RAB9AKMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL9332261 0.78 ESR1 (0.81) RAB9AKMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL21817022 0.77 RAB9A (1.00) RAB9AKMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL29350835 0.77 RAB9A (1.00) RAB9AKMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL42716 0.77 RAB9A (1.00) RAB9AKMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL5353302 0.77 ALDH1A1 (0.60) RAB9AKMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL7791036 0.76 RAB9A (0.96) RAB9AKMT2AALDH1A1MAPTSMN1; SMN2
Methane SCHEMBL725576 0.76 RAB9A (0.96) RAB9AKMT2AALDH1A1MAPTSMN1; SMN2

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
Send feedback