SCHEMBL6893609

SCHEMBL6893609

C[C@@H](O)[C@H]1C(=O)N2[C@@H](C(=O)OCc3ccc([N+](=O)[O-])cc3)C(=O)[C@H](C)[C@H]12

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.48
HTR2A P28223 1/20 0.43
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
ATM Q13315 1/20 0.40
HTT P42858 1/20 0.39
MAOB P27338 1/20 0.38

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
SCHEMBL10768544 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL10675931 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL14875217 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL2062622 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL9039878 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL18036888 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL10767245 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL10758551 1.00 ELANE (0.48) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL10670342 0.91 HTR2A (0.43) ELANEHTR2AALDH1A1MAPTHPGD
SCHEMBL10676045 0.91 HTR2A (0.43) ELANEHTR2AALDH1A1MAPTHPGD

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