SCHEMBL29460862

SCHEMBL29460862

CCCCCCCC(CC)c1ccnc(C(N)=O)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 2/20 0.37
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ CHRM2 P08172 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ ADRA2A P08913 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ OPRK1 P41145 1/20 0.35
▸ HTR2B P41595 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ FAAH O00519 8/20 0.34
▸ APAF1 O14727 1/20 0.34
▸ RGS12 O14924 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ DAGLA Q9Y4D2 5/20 0.33
▸ ADA P00813 2/20 0.33
▸ PRSS1 P07477 1/20 0.33

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
SCHEMBL29460897 0.73 NR1I2 (0.36) NR1I2MEN1KMT2A
SCHEMBL24971855 0.73 TLR8 (0.50) ADA
SCHEMBL18401337 0.72 TLR8 (0.49) ADA
SCHEMBL26489338 0.71 TLR8 (0.34) NR1I2
SCHEMBL23869472 0.71 GPR84 (0.35) NR1I2FAAHADA
SCHEMBL21715700 0.70 NR1I2 (0.33) NR1I2MAPT
SCHEMBL22308557 0.70 NR1I2 (0.40) NR1I2LMNACYP3A4MAPTFAAH
SCHEMBL26078439 0.70 NR1I2 (0.40) NR1I2LMNACYP3A4MAPTFAAH
SCHEMBL4450757 0.70 MEN1 (0.40) NR1I2MEN1KMT2ALMNACHRM2
SCHEMBL29460891 0.70 MEN1 (0.40) NR1I2MEN1KMT2ALMNACHRM2

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-114149413-A 3- ((hetero) aryl) -8-amino-2-oxo-1, 3-aza-spiro- [4.5] -decane derivatives 格吕伦塔尔有限公司 2022-03-08 — — CN disclosed
Send feedback