SCHEMBL9746545

SCHEMBL9746545

C#CCOCc1c(-c2ccccc2)nc2c(OCc3ccccc3)cccn12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 4/20 0.53
ATP4B P51164 4/20 0.53
CYP1A2 P05177 2/20 0.53
CYP3A4 P08684 2/20 0.53
CYP2C9 P11712 2/20 0.53
MEN1 O00255 1/20 0.53
CYP2D6 P10635 1/20 0.53
MAPK1 P28482 1/20 0.53
BLM P54132 1/20 0.53
PMP22 Q01453 1/20 0.53
KMT2A Q03164 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
PSEN1 P49768 9/20 0.40
PSEN2 P49810 9/20 0.40
APH1B Q8WW43 9/20 0.40
NCSTN Q92542 9/20 0.40
APH1A Q96BI3 9/20 0.40
PSENEN Q9NZ42 9/20 0.40
AKT1 P31749 1/20 0.37
AKT2 P31751 1/20 0.37

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
SCHEMBL9747019 0.86 ATP4A (0.69) ATP4AATP4BCYP1A2CYP3A4CYP2C9
Hydrochloric Acid SCHEMBL9746683 0.85 ATP4A (0.67) ATP4AATP4BCYP1A2CYP3A4CYP2C9
SCHEMBL9746607 0.79 ATP4A (0.58) ATP4AATP4BCYP1A2CYP3A4CYP2C9
Iodide SCHEMBL9746994 0.78 ATP4A (0.57) ATP4AATP4BCYP1A2CYP3A4CYP2C9
SCHEMBL9746597 0.77 ATP4A (0.46) ATP4AATP4BCYP1A2CYP3A4CYP2C9
SCHEMBL9746444 0.77 ATP4A (0.56) ATP4AATP4BCYP1A2CYP3A4CYP2C9
SCHEMBL8685033 0.75 ATP4A (0.80) ATP4AATP4BCYP1A2CYP3A4CYP2C9
SCHEMBL9747234 0.74 ATP4A (0.53) ATP4AATP4BCYP1A2CYP3A4CYP2C9
SCHEMBL9747025 0.73 PSEN1 (0.60) ATP4AATP4BCYP1A2CYP3A4CYP2C9
SCHEMBL10673635 0.72 ATP4A (0.53) ATP4AATP4BCYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4725601-A Certain imidazo[1,2-a]pyridines useful in the treatment of ulcers FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-02-16 US claimed
EP-0204285-A1 Imidazoheterocyclic compounds processes for preparation thereof and pharmaceutical compositions comprising them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-12-10 EP claimed
EP-0204285-B1 IMIDAZOHETEROCYCLIC COMPOUNDS PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-01-15 EP disclosed
EP-0339071-A1 IMIDAZO(1,2-a)(PYRIDAZINES OR PYRAZINES) FOR TREATMENT OF DISEASES RELATED TO BONE LOSS Aktiebolaget Hässle (SE) 1989-11-02 EP disclosed
WO-1989003833-A1 IMIDAZO(1,2-a)(PYRIDAZINES OR PYRAZINES) FOR TREATMENT OF DISEASES RELATED TO BONE LOSS Aktiebolaget Hässle (SE) 1989-05-05 WO 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