SCHEMBL11596378

SCHEMBL11596378

C=CCNC(=S)NCCCCCCCCCCCC

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.51
EPHX2 P34913 1/20 0.50
ZDHHC20 Q5W0Z9 1/20 0.50
ZDHHC2 Q9UIJ5 1/20 0.50
EPHX1 P07099 5/20 0.44
KDM4E B2RXH2 1/20 0.43
GAA P10253 3/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HPGD P15428 1/20 0.43
LMNA P02545 1/20 0.42
TSHR P16473 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
SCHEMBL11523175 1.00 FAAH (0.51) FAAHEPHX2ZDHHC20ZDHHC2EPHX1
SCHEMBL11596878 1.00 FAAH (0.51) FAAHEPHX2ZDHHC20ZDHHC2EPHX1
SCHEMBL11244943 1.00 FAAH (0.51) FAAHEPHX2ZDHHC20ZDHHC2EPHX1
SCHEMBL5443617 1.00 FAAH (0.51) FAAHEPHX2ZDHHC20ZDHHC2EPHX1
SCHEMBL11594801 1.00 FAAH (0.51) FAAHEPHX2ZDHHC20ZDHHC2EPHX1
SCHEMBL11595342 1.00 FAAH (0.51) FAAHEPHX2ZDHHC20ZDHHC2EPHX1
SCHEMBL7973521 0.98 FAAH (0.49) FAAHEPHX2ZDHHC20ZDHHC2EPHX1
SCHEMBL11336151 0.92 FAAH (0.46) FAAHEPHX2GAAALDH1A1MAPT
SCHEMBL11326200 0.85 TSHR (0.59) EPHX2ZDHHC20ZDHHC2EPHX1KDM4E
SCHEMBL13343232 0.84 ALDH1A1 (0.46) FAAHGAAALDH1A1MAPTSMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4097605-A Alkyl thiourea miticides STAUFFER CHEMICAL COMPANY (US) 1978-06-27 US claimed
US-10253256-B2 Use of sulfur and selenium compounds as precursors to nanostructured materials THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2019-04-09 US disclosed
US-20160237345-A1 USE OF SULFUR AND SELENIUM COMPOUNDS AS PRECURSORS TO NANOSTRUCTURED MATERIALS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2016-08-18 US disclosed
EP-3049370-A1 USE OF SULFUR AND SELENIUM COMPOUNDS AS PRECURSORS TO NANOSTRUCTURED MATERIALS The Trustees of Columbia University in the City of New York (US) 2016-08-03 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-10253256-B2 Use of sulfur and selenium compounds as precursors to nanostructured materials SCLY, TST, SOD1 FAAH 4020/4885EPHX2 2526/4885ZDHHC20 4104/4885

“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.