SCHEMBL29642010

SCHEMBL29642010

OB(O)Oc1ccc2nc3ccccc3cc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.52
HPGD P15428 4/20 0.52
MAPT P10636 3/20 0.52
GLA P06280 2/20 0.52
ACHE P22303 1/20 0.52
NQO2 P16083 2/20 0.41
KDM4E B2RXH2 5/20 0.41
KMT2A Q03164 3/20 0.41
NPC1 O15118 2/20 0.41
LMNA P02545 2/20 0.41
POLB P06746 2/20 0.41
RAB9A P51151 2/20 0.41
MEN1 O00255 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HTR3A P46098 1/20 0.41
GAA P10253 4/20 0.37
TDP1 Q9NUW8 1/20 0.37
STAT3 P40763 1/20 0.37
PTBP1 P26599 1/20 0.36
RCE1 Q9Y256 1/20 0.36

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
SCHEMBL1811999 0.79 ALDH1A1 (0.54) ALDH1A1MAPTKDM4EKMT2ANPC1
SCHEMBL738388 0.79 CYP1A2 (0.52) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL29366312 0.79 CYP1A2 (0.52) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL30501661 0.77 CYP1A2 (0.47) ALDH1A1HPGDMAPTGLAACHE
SCHEMBL29168494 0.77 CYP1A2 (0.47) ALDH1A1HPGDMAPTGLAACHE
Acridine SCHEMBL27818980 0.77 ALDH1A1 (0.79) ALDH1A1HPGDMAPTGLAACHE
SCHEMBL1527016 0.77 ALDH1A1 (0.69) ALDH1A1HPGDMAPTGLAACHE
SCHEMBL30065110 0.77 ALDH1A1 (0.69) ALDH1A1HPGDMAPTGLAACHE
Anthracene SCHEMBL9879830 0.74 MAPT (0.94) ALDH1A1HPGDMAPTGLAACHE
Methylamine SCHEMBL14940561 0.74 CYP2A6 (0.52) ALDH1A1MAPTKDM4EKMT2ARAB9A

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
CN-114591328-B Carbazole derivative and application thereof 上海八亿时空先进材料有限公司 2023-06-13 CN disclosed
CN-114591328-A Carbazole derivative and application thereof 上海八亿时空先进材料有限公司 2022-06-07 CN disclosed