SCHEMBL9746183

SCHEMBL9746183

C#CCc1c(C)nc2c(OCc3c(Cl)cccc3Cl)cccn12

nearest known ligand 0.78

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.57
CYP3A4 P08684 2/20 0.57
CYP2D6 P10635 2/20 0.57
CYP2C9 P11712 2/20 0.57
ATP4A P20648 2/20 0.57
ATP4B P51164 2/20 0.57
MEN1 O00255 1/20 0.57
MAPK1 P28482 1/20 0.57
BLM P54132 1/20 0.57
PMP22 Q01453 1/20 0.57
KMT2A Q03164 1/20 0.57
HDAC6 Q9UBN7 1/20 0.57
CYP2C19 P33261 1/20 0.54

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
SCHEMBL9746953 0.90 CYP3A4 (0.68) CYP1A2CYP3A4CYP2D6CYP2C9ATP4A
SCHEMBL9747667 0.88 CYP1A2 (0.51) CYP1A2CYP3A4CYP2D6CYP2C9ATP4A
SCHEMBL9747746 0.88 ATP4A (0.59) CYP1A2CYP3A4CYP2D6CYP2C9ATP4A
SCHEMBL10560331 0.86 ATP4A (0.56) CYP1A2CYP3A4CYP2D6CYP2C9ATP4A
SCHEMBL9746970 0.85 ATP4A (0.65) CYP1A2CYP3A4CYP2D6CYP2C9ATP4A
Hydrochloric Acid SCHEMBL10565262 0.85 ATP4A (0.55) CYP1A2CYP3A4CYP2D6CYP2C9ATP4A
SCHEMBL9686421 0.85 CYP3A4 (0.58) CYP1A2CYP3A4CYP2D6CYP2C9ATP4A
SCHEMBL10560189 0.85 CYP1A2 (0.58) CYP1A2CYP3A4CYP2D6CYP2C9ATP4A
SCHEMBL9747165 0.85 ATP4A (0.62) CYP1A2CYP3A4CYP2D6CYP2C9ATP4A
SCHEMBL9748644 0.84 CYP1A2 (0.54) CYP1A2CYP3A4CYP2D6CYP2C9ATP4A

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 6 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 claimed
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
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