SCHEMBL29259408

SCHEMBL29259408

COc1ccc(C(=O)N2CCN(C=O)CC2)cn1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 8/20 0.62
KCNH2 Q12809 2/20 0.60
HRH3 Q9Y5N1 7/20 0.52
AKR1C1 Q04828 1/20 0.50
NNMT P40261 1/20 0.50
HPGD P15428 1/20 0.47

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
SCHEMBL22773723 0.84 GPR183 (0.62) GPR183KCNH2HRH3NNMTHPGD
SCHEMBL5909228 0.82 AKR1C1 (0.54) HRH3AKR1C1
SCHEMBL19225793 0.81 SMN1; SMN2 (0.65) GPR183KCNH2NNMTHPGD
SCHEMBL26487454 0.81 HRH3 (0.60) GPR183KCNH2HRH3NNMTHPGD
SCHEMBL20070482 0.80 HRH3 (0.69) GPR183KCNH2HRH3NNMTHPGD
SCHEMBL29259402 0.79 HPGD (0.69) GPR183AKR1C1HPGD
SCHEMBL23126259 0.78 GPR183 (0.59) GPR183KCNH2HRH3NNMTHPGD
SCHEMBL22812071 0.77 GPR183 (0.58) GPR183KCNH2HRH3NNMTHPGD
SCHEMBL22031223 0.77 HRH3 (0.71) GPR183KCNH2HRH3NNMTHPGD
SCHEMBL20070486 0.77 HRH3 (0.67) GPR183KCNH2HRH3HPGD

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-118201911-A Compounds and their use as GPR183 inhibitors 南京艾美斐生物医药科技有限公司 2024-06-14 CN claimed