SCHEMBL6893876

SCHEMBL6893876

COC(=O)/C=C/c1ncn2ccsc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
KDM4E B2RXH2 6/20 0.36
KMT2A Q03164 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
LMNA P02545 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
TYR P14679 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
MEN1 O00255 2/20 0.35
NFE2L2 Q16236 3/20 0.34
TTR P02766 1/20 0.33
APP P05067 1/20 0.33
MAPT P10636 4/20 0.33
HPGD P15428 2/20 0.33
HSD17B10 Q99714 2/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL6892971 0.85 KDM4E (0.33) KDM4ESMN1; SMN2LMNAMAPTTP53
SCHEMBL6892968 0.85 KDM4E (0.33) KDM4ESMN1; SMN2LMNAMAPTTP53
SCHEMBL6885653 0.68 KMT2A (0.31) KDM4EKMT2ASMN1; SMN2MEN1
SCHEMBL7629257 0.66 ERCC1 (0.32) ALDH1A1KDM4ESMN1; SMN2LMNAMAPT
SCHEMBL7301257 0.65 JAK2 (0.50) ALDH1A1KDM4EKMT2ASMN1; SMN2LMNA
SCHEMBL7301264 0.65 JAK2 (0.50) ALDH1A1KDM4EKMT2ASMN1; SMN2LMNA
SCHEMBL6891278 0.64 NPSR1 (0.39) ALDH1A1KDM4EKMT2ASMN1; SMN2MEN1
SCHEMBL1902674 0.63 LMNA (0.64) KDM4EKMT2ASMN1; SMN2LMNAMEN1
SCHEMBL1902671 0.63 LMNA (0.64) KDM4EKMT2ASMN1; SMN2LMNAMEN1
SCHEMBL9255626 0.62 KMT2A (0.49) ALDH1A1KDM4EKMT2ASMN1; SMN2LMNA

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 ALDH1A1 1161/4885KDM4E 1406/4885KMT2A 3040/4885

“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.