SCHEMBL8971767

SCHEMBL8971767

CC1CCCC(C)N1NC(=O)c1ccc(Cl)cc1S(N)(=O)=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.65
▸ KDM4E B2RXH2 1/20 0.65
▸ GLA P06280 1/20 0.65
▸ MAPT P10636 1/20 0.65
▸ HTT P42858 1/20 0.65
▸ HSD17B10 Q99714 1/20 0.65
▸ ACHE P22303 2/20 0.47
▸ F10 P00742 1/20 0.43
▸ PSEN1 P49768 1/20 0.42
▸ PSEN2 P49810 1/20 0.42
▸ APH1B Q8WW43 1/20 0.42
▸ NCSTN Q92542 1/20 0.42
▸ APH1A Q96BI3 1/20 0.42
▸ PSENEN Q9NZ42 1/20 0.42
▸ KMT2A Q03164 2/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ HSD11B1 P28845 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ CA12 O43570 3/20 0.39

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
SCHEMBL31151392 1.00 LMNA (0.65) LMNAKDM4EGLAMAPTHTT
SCHEMBL27462399 0.79 LMNA (0.83) LMNAKDM4EGLAMAPTHTT
Clopamide SCHEMBL124598 0.79 KDM4E (1.00) LMNAKDM4EGLAMAPTHTT
Clopamide SCHEMBL1650071 0.79 KDM4E (1.00) LMNAKDM4EGLAMAPTHTT
SCHEMBL8971757 0.73 CA1 (0.52) LMNAKDM4EGLAMAPTHTT
SCHEMBL21962924 0.69 CA2 (0.61) KDM4EGLAMAPTHSD17B10SMN1; SMN2
SCHEMBL10743411 0.68 CA1 (0.56) KDM4EMAPTHSD17B10PTPN1SMN1; SMN2
SCHEMBL11024029 0.68 CA1 (0.46) LMNAKDM4EMAPTHSD17B10SMN1; SMN2
SCHEMBL11929010 0.66 LMNA (0.60) LMNAKDM4EGLAMAPTHTT
SCHEMBL3456234 0.65 SMN1; SMN2 (0.55) HTTACHEKMT2ASMN1; SMN2HSD11B1

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-5510489-A Method of preparing 1-amino-2, 6-dimethylpiperidine CASSELLA AKTIENGESELLSCHAFT (DE) 1996-04-23 — — US disclosed
Send feedback