SCHEMBL3334072

SCHEMBL3334072

O=C(O)c1ncsc1C=CSC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
KIF11 P52732 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
SCHEMBL3334068 1.00 KDM4E (0.44) KDM4EALDH1A1MAPTSMN1; SMN2CYP1A2
SCHEMBL3329351 0.91 KDM4E (0.35) KDM4EMAPTCYP1A2CYP2D6KIF11
SCHEMBL3329349 0.91 KDM4E (0.35) KDM4EMAPTCYP1A2CYP2D6KIF11
SCHEMBL3329991 0.87 KDM4E (0.35) KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL3332677 0.87 KIF11 (0.37) KDM4EKIF11
SCHEMBL3332133 0.87 KIF11 (0.38) KDM4EALDH1A1KIF11
SCHEMBL3330371 0.87 KDM4E (0.35) KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL3329995 0.87 KDM4E (0.35) KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL3331631 0.84 HPGD (0.33) KDM4EALDH1A1SMN1; SMN2
SCHEMBL3331635 0.84 HPGD (0.33) KDM4EALDH1A1SMN1; SMN2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8344154-B2 2-thioethenyl substituted carbapenem derivatives MEIJI SEIKA KAISHA, LTD. (JP) 2013-01-01 US disclosed
US-20100145063-A1 2- thioethenyl substituted carbapenem derivatives MARUYAMA TAKAHISA 2010-06-10 US disclosed
US-7687490-B2 2-thioethenyl substituted carbapenem derivatives MEIJI SEIKA KAISHA, LTD. (JP) 2010-03-30 US disclosed
EP-1870412-A1 2-THIOETHENYL CARBAPENEM DERIVATIVE MEIJI SEIKA KAISHA LTD. (JP) 2007-12-26 EP disclosed
US-20070004700-A1 2-Thioethenyl substituted carbapenem derivatives MEIJI SEIKA KAISHA, LTD. (JP) 2007-01-04 US 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 (2 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-20100145063-A1 2- thioethenyl substituted carbapenem derivatives MTAP, BLVRB, TPMT KDM4E 3386/4885ALDH1A1 1218/4885MAPT 3619/4885
US-20070004700-A1 2-Thioethenyl substituted carbapenem derivatives MTAP, BLVRB, BPGM KDM4E 2518/4885ALDH1A1 1182/4885MAPT 3579/4885

“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.