SCHEMBL27366145

SCHEMBL27366145

O=[C]OCCOc1cccc2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 12/20 0.59
KCNA3 P22001 1/20 0.56
HTR1D P28221 3/20 0.54
SLC6A4 P31645 2/20 0.53
HRH1 P35367 1/20 0.53
ALDH1A1 P00352 3/20 0.51
HPGD P15428 3/20 0.51
KDM4E B2RXH2 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
NR2E1 Q9Y466 1/20 0.49
MEN1 O00255 1/20 0.49
NPC1 O15118 1/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 1/20 0.49
RAB9A P51151 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL5289923 0.85 HTR1B (0.77) HTR1BKCNA3HTR1DSLC6A4HRH1
SCHEMBL7352198 0.81 HTR1B (0.61) HTR1BKCNA3HTR1DSLC6A4HRH1
SCHEMBL8674828 0.80 HTR1B (0.69) HTR1BKCNA3HTR1DSLC6A4HRH1
SCHEMBL8642238 0.80 HTR1B (0.69) HTR1BKCNA3HTR1DSLC6A4HRH1
SCHEMBL7162391 0.79 HTR1B (0.62) HTR1BKCNA3HTR1DSLC6A4HRH1
SCHEMBL9770352 0.79 KCNA3 (0.81) HTR1BKCNA3HTR1DSLC6A4HRH1
SCHEMBL2177350 0.79 HTR1B (0.78) HTR1BKCNA3HTR1DSLC6A4HRH1
SCHEMBL1193662 0.78 HTR1B (0.67) HTR1BKCNA3HTR1DSLC6A4HRH1
SCHEMBL7347356 0.78 KCNA3 (0.63) HTR1BKCNA3HTR1DSLC6A4HRH1
SCHEMBL16902840 0.77 KCNA3 (0.79) HTR1BKCNA3HTR1DSLC6A4HRH1

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-1054598-C Pharmacologically active hydrazine derivatives and processes for preparation thereof NORVATIS CO (CH) 2000-07-19 CN disclosed
CN-1068333-A Has hydrazine analog derivative of pharmacologically active and preparation method thereof CIBA GEIGY AG (CH) 1993-01-27 CN disclosed