SCHEMBL11069836

SCHEMBL11069836

Cc1nc2c(OCc3ccc(F)cc3)cccn2c1CO

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 3/20 0.82
ATP4B P51164 3/20 0.82
CYP1A2 P05177 2/20 0.61
CYP3A4 P08684 2/20 0.61
CYP2D6 P10635 2/20 0.61
CYP2C9 P11712 2/20 0.61
MEN1 O00255 1/20 0.61
MAPK1 P28482 1/20 0.61
BLM P54132 1/20 0.61
PMP22 Q01453 1/20 0.61
KMT2A Q03164 1/20 0.61
HDAC6 Q9UBN7 1/20 0.61
PSEN1 P49768 8/20 0.53
PSEN2 P49810 8/20 0.53
APH1B Q8WW43 8/20 0.53
NCSTN Q92542 8/20 0.53
APH1A Q96BI3 8/20 0.53
PSENEN Q9NZ42 8/20 0.53
CYP2C19 P33261 1/20 0.48
GUCY1B2 O75343 3/20 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
SCHEMBL1813915 0.90 ATP4A (1.00) ATP4AATP4BCYP1A2CYP3A4CYP2D6
SCHEMBL11384760 0.89 ATP4A (0.80) ATP4AATP4BCYP1A2CYP3A4CYP2D6
SCHEMBL2192096 0.89 ATP4A (0.80) ATP4AATP4BCYP1A2CYP3A4CYP2D6
SCHEMBL11098130 0.89 ATP4A (0.75) ATP4AATP4BCYP1A2CYP3A4CYP2D6
SCHEMBL11064068 0.88 ATP4A (0.63) ATP4AATP4BCYP1A2CYP3A4CYP2D6
SCHEMBL2197694 0.87 ATP4A (0.77) ATP4AATP4BCYP1A2CYP3A4CYP2D6
SCHEMBL2192635 0.86 ATP4A (0.83) ATP4AATP4BCYP1A2CYP3A4CYP2D6
SCHEMBL11070692 0.86 ATP4A (0.61) ATP4AATP4BCYP1A2CYP3A4CYP2D6
SCHEMBL7499510 0.85 ATP4A (0.66) ATP4AATP4BCYP1A2CYP3A4CYP2D6
Iodomethane SCHEMBL11064047 0.84 ATP4A (0.58) ATP4AATP4BCYP1A2CYP3A4CYP2D6

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-0033094-B1 IMIDAZO(1,2-A)PYRIDINES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING CORPORATION (US) 1984-10-10 EP disclosed
US-4450164-A ANTIULCER AND ANTISECRETORY AGENTS SCHERING CORPORATION (US) 1984-05-22 US disclosed
EP-0033094-A1 Imidazo(1,2-a)pyridines, processes for their preparation and pharmaceutical compositions containing them SCHERING CORPORATION (US) 1981-08-05 EP disclosed