SCHEMBL6897358

SCHEMBL6897358

CCOC(=O)OC1(C)CCC(C(C)C)CC1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
SOAT1 P35610 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
HCRTR2 O43614 1/20 0.32
TRPM8 Q7Z2W7 1/20 0.31
GPBAR1 Q8TDU6 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL4063068 0.86 SCN1A (0.30)
SCHEMBL20836246 0.84
SCHEMBL13457064 0.80 ALDH1A1 (0.52) ALDH1A1SOAT1L3MBTL1TSHR
SCHEMBL31149439 0.79 SCN1A (0.30)
SCHEMBL11099319 0.79 PPM1B (0.44) ALDH1A1SOAT1L3MBTL1
SCHEMBL29469592 0.78 SCN1A (0.31)
SCHEMBL614026 0.78 SCN1A (0.31)
SCHEMBL118103 0.78 ALOX15 (0.34) TSHR
SCHEMBL11692287 0.78 OPRL1 (0.32)
SCHEMBL30152433 0.77 ALDH1A1 (0.35) ALDH1A1HCRTR2GPBAR1

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-6677331-B2 HAVING SUBSTITUTED IMIDAZO(5,1-B)THIAZOLE GROUP AT 2-POSITION; MICROBIOCIDES AGAINST BETA-LACTAMASE PRODUCING BACTERIA AND RESISTANT PSEUDOMONAS MEIJI SEIKA KAISHA, LTD. (JP) 2004-01-13 US disclosed
US-6458780-B1 IMIDAZO(5,1-B)THIAZOLE GROUP AT THE 2-POSITION ON THE CARBAPENEM RING HAVE HIGH ANTI-MICROBIAL ACTIVITIES AGAINST .BETA.-LACTAMASE PRODUCING BACTERIA, MRSA, RESISTANT-PSEUDOMONAS AERUGINOSA, PRSP, ENTEROCOCCI, AND MEIJI SEIKA KAISHA, LTD. (JP) 2002-10-01 US disclosed