SCHEMBL30704392

SCHEMBL30704392

O=c1[nH]c2ccc(O)cc2[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 3/20 0.50
PDE3A Q14432 3/20 0.50
GAA P10253 5/20 0.48
PKM P14618 1/20 0.48
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 2/20 0.47
GLA P06280 1/20 0.47
HPGD P15428 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
POLB P06746 1/20 0.46
CASP6 P55212 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
GRIA1 P42261 3/20 0.44
CACNG8 Q8WXS5 3/20 0.44
ABL1 P00519 1/20 0.44
PDGFRB P09619 1/20 0.44
KIT P10721 1/20 0.44
BCR P11274 1/20 0.44
FLT3 P36888 1/20 0.44

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
SCHEMBL3226331 1.00 PDE3B (0.50) PDE3BPDE3AGAAPKMALDH1A1
SCHEMBL17434450 0.79 CA12 (0.54) PDE3BPDE3AGAAALDH1A1KDM4E
SCHEMBL16198465 0.76 ALDH1A1 (0.56) GAAALDH1A1KDM4EHPGDMEN1
SCHEMBL22424899 0.74 MAPT (0.68) GAAALDH1A1KDM4EMEN1KMT2A
SCHEMBL21927159 0.72 AURKA (0.47) PDE3BPDE3AGAAALDH1A1KDM4E
SCHEMBL22425308 0.72 MAPT (0.63) GAAALDH1A1KDM4EHPGDMEN1
SCHEMBL22424889 0.72 MAPT (0.60) GAAALDH1A1KDM4EHPGDMEN1
SCHEMBL13293335 0.71 GAA (0.48) PDE3BPDE3AGAAPKMALDH1A1
SCHEMBL92048 0.71 GAA (0.53) PDE3BPDE3AGAAPKMKDM4E
SCHEMBL3348374 0.71 GAA (0.48) PDE3BPDE3AGAAPKMALDH1A1

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
CN-117327065-A Carbazole derivatives as dopamine D2/3 receptor modulators 北京大学 2024-01-02 CN disclosed