SCHEMBL13797005

SCHEMBL13797005

CC(C)(C)OC(=O)NNc1nc(NC[C@H]2CC[C@H](CNS(=O)(=O)c3cc(Cl)cc(Cl)c3)CC2)nc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 6/20 0.52
▸ NPY5R Q15761 10/20 0.49
▸ SLC6A4 P31645 2/20 0.49
▸ AQP1 P29972 2/20 0.47
▸ ACACA Q13085 2/20 0.47
▸ ADRA2A P08913 6/20 0.46
▸ MCHR1 Q99705 5/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ NPY1R P25929 1/20 0.46
▸ NPY2R P49146 1/20 0.46
▸ NPY4R P50391 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ MEN1 O00255 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SOS1 Q07889 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
SCHEMBL13796967 0.94 ACACB (0.51) ACACBNPY5RSLC6A4AQP1ACACA
SCHEMBL13796416 0.92 ACACB (0.54) ACACBNPY5RSLC6A4AQP1ACACA
SCHEMBL14606734 0.90 ACACB (0.54) ACACBNPY5RSLC6A4AQP1ACACA
SCHEMBL13796959 0.90 ACACB (0.54) ACACBNPY5RSLC6A4AQP1ACACA
SCHEMBL13796435 0.89 ACACB (0.53) ACACBNPY5RSLC6A4AQP1ACACA
SCHEMBL13796972 0.89 ACACB (0.64) ACACBNPY5RSLC6A4AQP1ACACA
SCHEMBL13796971 0.89 AQP1 (0.57) ACACBNPY5RSLC6A4AQP1ACACA
SCHEMBL13795913 0.89 NPY5R (0.57) ACACBNPY5RSLC6A4AQP1ACACA
SCHEMBL13796372 0.89 ACACB (0.53) ACACBNPY5RSLC6A4AQP1ACACA
SCHEMBL13796376 0.88 NPY5R (0.51) ACACBNPY5RSLC6A4AQP1ACACA

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