SCHEMBL27577321

SCHEMBL27577321

CN(Cc1cccnc1)C1CCN(C(=O)O)CC1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.70
KDM4E B2RXH2 2/20 0.70
CHRNB2 P17787 2/20 0.50
CHRNA4 P43681 2/20 0.50
LMNA P02545 1/20 0.48
OPRK1 P41145 1/20 0.46
POLB P06746 1/20 0.46
RIPK1 Q13546 1/20 0.44
KMT2A Q03164 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
DHODH Q02127 1/20 0.43
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43
MCHR1 Q99705 1/20 0.42
VNN1 O95497 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
NAPRT Q6XQN6 1/20 0.42
CHRM1 P11229 1/20 0.42

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
SCHEMBL27564862 0.86 KDM4E (0.51) ALDH1A1KDM4ECHRNB2CHRNA4POLB
SCHEMBL785972 0.85 JAK2 (0.54) ALDH1A1KDM4EKMT2ACHRM2JAK2
SCHEMBL27547624 0.83 KDM4E (0.51) ALDH1A1KDM4ECHRNB2CHRNA4LMNA
SCHEMBL6583746 0.82 KDM4E (0.78) ALDH1A1KDM4ECHRNB2CHRNA4LMNA
SCHEMBL27544648 0.82 KDM4E (0.47) ALDH1A1KDM4ECHRNB2CHRNA4POLB
SCHEMBL3984660 0.79 KMT2A (0.46) ALDH1A1KDM4EKMT2AJAK2JAK1
SCHEMBL3130725 0.78 KDM4E (0.72) ALDH1A1KDM4ECHRNB2CHRNA4OPRK1
SCHEMBL18424508 0.78 KMT2A (0.56) KMT2ACHRM2JAK2JAK1MCHR1
SCHEMBL17297788 0.77 ALDH1A1 (0.70) ALDH1A1KDM4ECHRNB2CHRNA4LMNA
SCHEMBL13744576 0.77 ALDH1A1 (0.70) ALDH1A1KDM4ECHRNB2CHRNA4LMNA

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
CN-1602191-A Compounds and uses thereof for decreasing activity of hormone-sensitive lipase NOVO NORDISK AS (DK) 2005-03-30 CN claimed
CN-1326519-C Compounds and uses thereof for decreasing activity of hormone-sensitive lipase NOVO NORDISK AS (DK) 2007-07-18 CN disclosed
CN-1602191-A Compounds and uses thereof for decreasing activity of hormone-sensitive lipase NOVO NORDISK AS (DK) 2005-03-30 CN disclosed