SCHEMBL11097309

SCHEMBL11097309

N#Cc1ccc(C2=NNC(=O)CC2CO)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 7/20 0.46
▸ PDE3B Q13370 8/20 0.44
▸ PDE3A Q14432 8/20 0.44
▸ TNNC1 P63316 1/20 0.44
▸ PDE2A O00408 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.37

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
SCHEMBL11013347 0.82 PDE3B (0.45) GPR119PDE3BPDE3ATNNC1PDE2A
SCHEMBL10956557 0.82 PDE3B (0.48) GPR119PDE3BPDE3ATNNC1PDE2A
SCHEMBL11625496 0.79 GPR119 (0.66) GPR119PDE3BPDE3ATNNC1KDM4E
SCHEMBL10961794 0.78 GPR119 (0.54) GPR119PDE3BPDE3ATNNC1PDE2A
SCHEMBL10961439 0.78 PDE3B (0.46) GPR119PDE3BPDE3ATNNC1PDE2A
SCHEMBL10959297 0.76 GPR119 (0.48) GPR119PDE3BPDE3APDE2AHRH3
SCHEMBL10961657 0.75 PDE3B (0.45) GPR119PDE3BPDE3APDE2AKDM4E
SCHEMBL11046458 0.75 PDE3B (0.71) PDE3BPDE3ATNNC1PDE2AKDM4E
SCHEMBL10703150 0.75 PDE3B (0.55) GPR119PDE3BPDE3A
SCHEMBL10704539 0.74 PDE3B (0.68) GPR119PDE3BPDE3APDE2AKDM4E

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
EP-0129791-A2 Tetrahydropyridazinone derivatives, process for their preparation and their use CASSELLA Aktiengesellschaft (DE) 1985-01-02 — — EP disclosed
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