SCHEMBL6895920

SCHEMBL6895920

CCOC(=O)Oc1ccccc1C(C)C

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C19 P33261 1/20 0.47
NLRP3 Q96P20 3/20 0.47
SCN5A Q14524 1/20 0.46
SCN9A Q15858 1/20 0.46
SCN10A Q9Y5Y9 1/20 0.46
CES2 O00748 1/20 0.45
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
GLA P06280 1/20 0.41
LMNA P02545 1/20 0.41
TYMS P04818 1/20 0.41

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
SCHEMBL18050401 0.87 TSHR (0.45) TSHRNLRP3SCN5ASCN9ASCN10A
SCHEMBL991362 0.86 TSHR (0.50) TSHRCYP1A2CYP2C19CES2KMT2A
SCHEMBL11170809 0.85 TSHR (0.49) TSHRCYP1A2CYP2C19SCN5ASCN9A
SCHEMBL18050544 0.84 TDP1 (0.40) TSHRNLRP3SCN5ASCN9ASCN10A
SCHEMBL18050602 0.84 TDP1 (0.40) TSHRNLRP3SCN5ASCN9ASCN10A
SCHEMBL8516383 0.84 TSHR (0.52) TSHRKMT2AMEN1L3MBTL1GLA
SCHEMBL18050446 0.83 NLRP3 (0.42) TSHRNLRP3KMT2AMEN1LMNA
SCHEMBL28381341 0.83 L3MBTL1 (0.42) TSHRKMT2AMEN1L3MBTL1GLA
SCHEMBL11208068 0.82 TSHR (0.50) TSHRLMNA
SCHEMBL11165515 0.82 TSHR (0.50) TSHRLMNA

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 4 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-20030149016-A1 Novel carbapenem derivatives KANO YUKO (JP) 2003-08-07 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
EP-1101766-A1 NOVEL CARBAPENEM DERIVATIVES MEIJI SEIKA KAISHA LTD. (JP) 2001-05-23 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030149016-A1 Novel carbapenem derivatives DPEP1, TMPRSS15, STK35 TSHR 4209/4885CYP1A2 2616/4885CYP2C19 1159/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.