SCHEMBL8655775

SCHEMBL8655775

CCC1(c2ccccc2)NC(SCc2ccccc2N(C)C)=NC1=O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 3/20 0.38
TSHR P16473 2/20 0.38
LMNA P02545 2/20 0.34
AR P10275 1/20 0.34
ATP4A P20648 1/20 0.32
ATP4B P51164 1/20 0.32
HPGD P15428 2/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
KDM4E B2RXH2 1/20 0.30
OPRM1 P35372 1/20 0.30
OPRL1 P41146 1/20 0.30

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
SCHEMBL8656613 0.85 AR (0.36) TSHRLMNAARATP4AATP4B
SCHEMBL8658153 0.83 AR (0.36) TSHRLMNAARATP4AATP4B
SCHEMBL8656860 0.83 AR (0.36) TSHRLMNAARATP4AATP4B
SCHEMBL8654394 0.81 AR (0.38) TSHRLMNAARATP4AATP4B
Hydrochloric Acid SCHEMBL8656854 0.80 AR (0.37) TSHRLMNAARATP4AATP4B
SCHEMBL8655331 0.79 AR (0.35) TSHRLMNAARATP4AATP4B
SCHEMBL8658144 0.78 AR (0.33) ARATP4AATP4B
SCHEMBL8653915 0.77 GLA (0.44) CYP2C19TSHRLMNAMAPTL3MBTL1
SCHEMBL8656716 0.76 AR (0.34) TSHRLMNAARATP4AATP4B
SCHEMBL8658166 0.75 AR (0.39) TSHRLMNAARATP4AATP4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5733922-A Imidazole derivative, pharmaceutically acceptable salt thereof, and anti-ulcer drug including such derivative or salt ARAX CO., LTD. (JP) 1998-03-31 US disclosed
EP-0728747-A1 Imidazole derivative, pharmaceutically acceptable salt thereof, process of manufacture therefor, and anti-ulcer drug including such derivative or salt ARAX CO., LTD. (JP) 1996-08-28 EP disclosed