SCHEMBL28047941

SCHEMBL28047941

CN1C=CN(c2ccc(F)cc2)C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
MAPK1 P28482 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
GFER P55789 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TP53 P04637 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GSK3A P49840 1/20 0.34
GSK3B P49841 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
POLB P06746 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
SCHEMBL20414976 0.84 ALDH1A1 (0.41) LMNAMAPK1ALDH1A1MAPTHTT
Hydrochloric Acid SCHEMBL384463 0.77 MAPT (0.36) MAPK1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL14675935 0.76 KDM4E (0.42) LMNAALDH1A1MAPTTDP1TP53
SCHEMBL15993007 0.76 POLB (0.43) ALDH1A1MAPTHTTRAB9AGSK3A
SCHEMBL23884741 0.75 ALDH1A1 (0.49) MAPK1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL13876041 0.75 HRH3 (0.42) ALDH1A1TP53RAB9APOLBKDM4E
Bromide SCHEMBL1887327 0.74 DHFR (0.34) LMNAALDH1A1MAPTTP53NPC1
SCHEMBL4625962 0.73 RAB9A (0.45) LMNAALDH1A1MAPTNPC1RAB9A
Iodide SCHEMBL4213036 0.73 HRH3 (0.41) ALDH1A1TP53RAB9APOLBKDM4E
SCHEMBL18807591 0.72 MGLL (0.44) LMNAMAPK1ALDH1A1MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114989164-A Substituted 1H-imidazo [4,5-b ] pyridin-2 (3H) -ones and uses thereof 詹森药业有限公司 2022-09-02 CN disclosed
CN-110062761-B Substituted 1H-imidazo [4,5-b ] pyridin-2 (3H) -ones and uses thereof 詹森药业有限公司 2022-05-13 CN disclosed
CN-105189506-A Compounds and compositions for the treatment of parasitic diseases NOVARTIS AG 2015-12-23 CN disclosed
CN-101903381-A Novel compound having affinity for amyloid NIHON MEDIPHYSICS CO LTD 2010-12-01 CN disclosed