SCHEMBL8667152

SCHEMBL8667152

CC1(C)NC([S+]([O-])Cc2ccccc2N2CCCC2)=NC1=S

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.34
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
GAA P10253 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL8669446 0.91 HTR1A (0.39) CYP3A4CYP2C19
SCHEMBL8666979 0.81 MGLL (0.45)
SCHEMBL8669840 0.80 NR1H3 (0.39)
SCHEMBL8668788 0.78 ATP4A (0.30)
SCHEMBL8668509 0.76 AR (0.32)
SCHEMBL8668472 0.76 AR (0.32) L3MBTL1
SCHEMBL8667326 0.74 AR (0.34)
SCHEMBL8665501 0.74
SCHEMBL8666928 0.73
SCHEMBL8668497 0.73

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-5750552-A ANTIULCER AGENTS ARAX CO., LTD. (JP) 1998-05-12 US disclosed
EP-0736527-A1 Imadazoline derivative, possible tautomer thereof, process of manufacturing therefor, and vulnerary including such derivative or tautomer ARAX CO., LTD. (JP) 1996-10-09 EP disclosed