SCHEMBL10577929

SCHEMBL10577929

N#CN=C1NCCCN1C(=O)C1CC1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 1/20 0.34
▸ CHRNA3 P32297 1/20 0.34
▸ CHRNA4 P43681 1/20 0.34
▸ CHRNB3 Q05901 1/20 0.34
▸ CHRNA6 Q15825 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ BRD4 O60885 1/20 0.33
▸ ATAD2 Q6PL18 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ POLB P06746 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ ELANE P08246 2/20 0.31
▸ DPP4 P27487 1/20 0.30

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
SCHEMBL10574451 0.70 FAAH (0.38) TSHR
SCHEMBL10574455 0.70 FAAH (0.38) TSHR
SCHEMBL10577941 0.70 PAX8 (0.34) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL9765450 0.67 MEN1 (0.33) KMT2A
SCHEMBL10574736 0.66 MAPT (0.30) HTT
SCHEMBL9838117 0.64 FAAH (0.33) KMT2A
SCHEMBL11863841 0.63 ALDH1A1 (0.47) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL10576454 0.62 PDE4B (0.34) —
SCHEMBL10576457 0.62 PDE4B (0.34) —
SCHEMBL9127507 0.59 — —

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0277317-A1 Nitro derivatives of 2-iminoimidazolidines and 2-iminotetrahydropyrimidines NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1988-08-10 — — EP claimed
US-4880933-A INSECTICIDES NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1989-11-14 — — US disclosed
EP-0277317-A1 Nitro derivatives of 2-iminoimidazolidines and 2-iminotetrahydropyrimidines NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1988-08-10 — — EP disclosed
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