SCHEMBL29214483

SCHEMBL29214483

NC(COCc1ccccc1)C1CN(C(=O)O)C1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 1/20 0.48
TACR1 P25103 2/20 0.43
CA1 P00915 3/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
FOLH1 Q04609 1/20 0.40
DPP4 P27487 2/20 0.40
DPP7 Q9UHL4 2/20 0.40
MAPK1 P28482 1/20 0.40
GRM5 P41594 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL22559199 0.84 GPR119 (0.45) SLC1A1TACR1DPP4
SCHEMBL20601128 0.76 TEAD3 (0.46) SLC1A1DPP4DPP7GRM5
SCHEMBL20601126 0.76 TEAD3 (0.46) SLC1A1DPP4DPP7GRM5
SCHEMBL18580070 0.75 TACR1 (0.49) SLC1A1TACR1CA1CA2CA7
Hydrochloric Acid SCHEMBL8817784 0.75 TACR1 (0.49) SLC1A1TACR1CA1CA2CA7
SCHEMBL21855171 0.75 AGTR2 (0.51) GRM5
SCHEMBL3580922 0.74 GPR119 (0.56) DPP4
SCHEMBL23274792 0.73 ACHE (0.47)
SCHEMBL2791945 0.72 AGTR2 (0.53) GRM5
SCHEMBL3580578 0.72 TACR1 (0.46) SLC1A1TACR1CA1CA2CA7

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-114072207-B Bicyclic compounds 维瓦斯治疗公司 2024-03-29 CN disclosed