SCHEMBL14615565

SCHEMBL14615565

C=C(NCCc1ccc2ccccc2c1)C1CCNCC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 13/20 0.49
SLC6A2 P23975 12/20 0.49
SLC6A3 Q01959 11/20 0.49
HTR2A P28223 1/20 0.49
HTR2C P28335 1/20 0.49
HTR7 P34969 1/20 0.49
HTR2B P41595 1/20 0.49
HTR3A P46098 1/20 0.49
HTR4 Q13639 1/20 0.49
KCNH2 Q12809 5/20 0.44
GABRA1 P14867 3/20 0.42
GABRB2 P47870 3/20 0.42
CES2 O00748 1/20 0.41

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
SCHEMBL14615541 0.84 SLC6A4 (0.51) SLC6A4SLC6A2SLC6A3HTR2AHTR2C
SCHEMBL9130436 0.75 MTNR1A (0.54) CES2
SCHEMBL14527656 0.75 PLG (0.53)
SCHEMBL22160722 0.73 MC4R (0.63) SLC6A4SLC6A2SLC6A3CES2
SCHEMBL22178784 0.73 MC4R (0.63) SLC6A4SLC6A2SLC6A3CES2
SCHEMBL22178785 0.73 MC4R (0.63) SLC6A4SLC6A2SLC6A3CES2
SCHEMBL9131926 0.73 MTNR1A (0.56)
SCHEMBL31176222 0.73 MTNR1A (0.56)
SCHEMBL8097845 0.73 MTNR1A (0.56)
SCHEMBL7986820 0.73 SLC6A4 (0.57) SLC6A4SLC6A2SLC6A3HTR2AHTR2C

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-2007014258-A2 GROWTH HORMONE SECRETAGOGUES SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES S.A.S. (FR) 2007-02-01 WO disclosed