SCHEMBL9746607

SCHEMBL9746607

CN(C)Cc1c(-c2ccccc2)nc2c(OCc3ccccc3)cccn12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 3/20 0.58
ATP4B P51164 3/20 0.58
MEN1 O00255 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
MAPK1 P28482 1/20 0.56
BLM P54132 1/20 0.56
PMP22 Q01453 1/20 0.56
KMT2A Q03164 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
POLB P06746 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
SLC2A1 P11166 1/20 0.43
PSEN1 P49768 7/20 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
SCHEMBL11062878 0.86 ATP4A (0.74) ATP4AATP4BMEN1CYP1A2CYP3A4
Hydrochloric Acid SCHEMBL11071087 0.85 ATP4A (0.72) ATP4AATP4BMEN1CYP1A2CYP3A4
Iodomethane SCHEMBL11062859 0.84 ATP4A (0.71) ATP4AATP4BMEN1CYP1A2CYP3A4
Iodide SCHEMBL9746994 0.83 ATP4A (0.57) ATP4AATP4BMEN1CYP1A2CYP3A4
SCHEMBL11069863 0.83 ATP4A (0.66) ATP4AATP4BMEN1CYP1A2CYP3A4
Iodomethane SCHEMBL11062258 0.81 ATP4A (0.64) ATP4AATP4BMEN1CYP1A2CYP3A4
SCHEMBL9746545 0.79 ATP4A (0.53) ATP4AATP4BMEN1CYP1A2CYP3A4
SCHEMBL11070692 0.77 ATP4A (0.61) ATP4AATP4BMEN1CYP1A2CYP3A4
SCHEMBL9747064 0.76 ATP4A (0.60) ATP4AATP4BMEN1CYP1A2CYP3A4
SCHEMBL9748655 0.76 ATP4A (0.52) ATP4AATP4BMEN1CYP1A2CYP3A4

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
EP-0204285-B1 IMIDAZOHETEROCYCLIC COMPOUNDS PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-01-15 EP disclosed
US-4725601-A Certain imidazo[1,2-a]pyridines useful in the treatment of ulcers FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-02-16 US disclosed
EP-0204285-A1 Imidazoheterocyclic compounds processes for preparation thereof and pharmaceutical compositions comprising them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-12-10 EP disclosed