SCHEMBL13796653

SCHEMBL13796653

CC(C)(C)OC(=O)NCCCCNc1nc(NC[C@H]2CC[C@H](CNS(=O)(=O)c3ccccc3)CC2)nc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 5/20 0.55
▸ ACACA Q13085 2/20 0.48
▸ NPY5R Q15761 10/20 0.47
▸ SLC6A4 P31645 2/20 0.47
▸ ADRA2A P08913 6/20 0.47
▸ MCHR1 Q99705 5/20 0.47
▸ AQP1 P29972 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ MAPT P10636 1/20 0.47
▸ NPY1R P25929 1/20 0.47
▸ NPY2R P49146 1/20 0.47
▸ NPY4R P50391 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ BRD4 O60885 3/20 0.45

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
SCHEMBL13795909 0.95 NPY5R (0.54) ACACBACACANPY5RSLC6A4ADRA2A
SCHEMBL13796941 0.95 ACACB (0.56) ACACBACACANPY5RSLC6A4ADRA2A
SCHEMBL14606850 0.95 ACACB (0.56) ACACBACACANPY5RSLC6A4ADRA2A
SCHEMBL13796373 0.95 ACACB (0.51) ACACBACACANPY5RSLC6A4ADRA2A
SCHEMBL13795906 0.95 ACACB (0.51) ACACBACACANPY5RSLC6A4ADRA2A
SCHEMBL13796966 0.95 ACACB (0.51) ACACBACACANPY5RSLC6A4ADRA2A
SCHEMBL13796963 0.93 ACACB (0.52) ACACBACACANPY5RSLC6A4ADRA2A
SCHEMBL13796962 0.93 ACACB (0.51) ACACBACACANPY5RSLC6A4ADRA2A
SCHEMBL13796663 0.92 ACACB (0.64) ACACBACACANPY5RSLC6A4ADRA2A
SCHEMBL13796372 0.92 ACACB (0.53) ACACBACACANPY5RSLC6A4ADRA2A

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
US-7544690-B2 MCH receptor antagonists TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-06-09 — — US disclosed
Send feedback