SCHEMBL28536155

SCHEMBL28536155

Clc1cnc(-c2ccccn2)[nH]1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 2/20 0.59
LMNA P02545 4/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
KDM4E B2RXH2 3/20 0.51
HPGDS O60760 3/20 0.51
POLB P06746 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
HTT P42858 1/20 0.51
BTK Q06187 1/20 0.49
METAP1 P53582 7/20 0.48
CCR1 P32246 2/20 0.48
CCR5 P51681 2/20 0.48
CCR8 P51685 2/20 0.48
CYP1A2 P05177 1/20 0.48
BLM P54132 1/20 0.48
HIF1A Q16665 1/20 0.48
DOHH Q9BU89 1/20 0.48
P4HTM Q9NXG6 1/20 0.48
METAP2 P50579 6/20 0.47

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
SCHEMBL5482508 0.78 NPY5R (0.77) NPY5RLMNASMN1; SMN2KDM4EHPGDS
SCHEMBL16566337 0.77 NPY5R (0.59) NPY5RLMNASMN1; SMN2KDM4EHPGDS
SCHEMBL16547523 0.77 NPY5R (0.59) NPY5RLMNASMN1; SMN2KDM4EHPGDS
SCHEMBL18015254 0.77 NPY5R (0.59) NPY5RLMNASMN1; SMN2KDM4EHPGDS
SCHEMBL2896103 0.77 NPY5R (0.59) NPY5RLMNASMN1; SMN2KDM4EHPGDS
SCHEMBL28542982 0.74 SCN2A (0.61) NPY5RHPGDS
SCHEMBL16543460 0.73 NPY5R (0.54) NPY5RLMNASMN1; SMN2KDM4EHPGDS
SCHEMBL5478697 0.73 KDM4E (0.59) NPY5RLMNASMN1; SMN2KDM4EPOLB
Dipyridyl SCHEMBL6504788 0.69 KDM4E (0.78) LMNASMN1; SMN2KDM4EPOLBTDP1
SCHEMBL20595286 0.69 NPY5R (0.50) NPY5RLMNASMN1; SMN2KDM4EHPGDS

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-109126875-B Carbon 60-bidentate nitrogen heterocyclic carbene palladium (0) compound and preparation method and application thereof 洛阳师范学院 2021-03-16 CN disclosed