SCHEMBL27645407

SCHEMBL27645407

c1ccc(CCN2CCC(c3ccccc3)(c3nn[nH]n3)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.55
TET3 O43151 1/20 0.55
FBXL19 Q6PCT2 1/20 0.55
CXXC5 Q7LFL8 1/20 0.55
TET1 Q8NFU7 1/20 0.55
KDM2B Q8NHM5 1/20 0.55
CXXC4 Q9H2H0 1/20 0.55
KDM2A Q9Y2K7 1/20 0.55
PRCP P42785 2/20 0.46
SIGMAR1 Q99720 6/20 0.44
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
HTR2B P41595 1/20 0.44
SLC6A3 Q01959 1/20 0.44
LMNA P02545 1/20 0.43
CHRM2 P08172 1/20 0.43
ADRA2A P08913 1/20 0.43
CYP2D6 P10635 1/20 0.43
TSHR P16473 1/20 0.43
DRD1 P21728 1/20 0.43

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
SCHEMBL2529201 0.87 KMT2A (0.57) KMT2ATET3FBXL19CXXC5TET1
SCHEMBL11742308 0.81 SLC6A3 (0.61) SIGMAR1HTR2AHTR2CHTR2BSLC6A3
Hydrochloric Acid SCHEMBL11738853 0.79 SLC6A3 (0.59) KMT2ASIGMAR1HTR2AHTR2CHTR2B
SCHEMBL6017029 0.78 OPRM1 (0.66) KMT2ATET3FBXL19CXXC5TET1
SCHEMBL13435360 0.78 KCNA3 (0.59) KMT2ATET3FBXL19CXXC5TET1
SCHEMBL12216179 0.77 KMT2A (0.54) KMT2ATET3FBXL19CXXC5TET1
SCHEMBL2525815 0.74 OPRM1 (0.57) KMT2ATET3FBXL19CXXC5TET1
SCHEMBL2526312 0.74 OPRM1 (0.59) KMT2ATET3FBXL19CXXC5TET1
SCHEMBL14520965 0.73 TET3 (0.72) KMT2ATET3FBXL19CXXC5TET1
Hydrochloric Acid SCHEMBL2529676 0.73 OPRM1 (0.58) KMT2ATET3FBXL19CXXC5TET1

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-1914192-A Process for preparing 4-tetrazolyl-4-phenylpiperidine compounds EURO CELTIQUE SA (LU) 2007-02-14 CN disclosed