SCHEMBL2107888

SCHEMBL2107888

C=CCSC(=N)NC(N)=S

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
MITF O75030 1/20 0.31

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
Acetic Acid SCHEMBL9631051 0.90 TAS2R38 (0.38) ALDH1A1TSHRMITF
SCHEMBL9353535 0.83 TRPA1 (0.31) ALDH1A1
Bromide SCHEMBL10656257 0.82 HRH4 (0.31)
Hydrochloric Acid SCHEMBL10655702 0.82
SCHEMBL461758 0.71
SCHEMBL175816 0.71
Hydrochloric Acid SCHEMBL10653382 0.71
SCHEMBL11060370 0.70
Bromide SCHEMBL1263032 0.69
Iodide SCHEMBL11806511 0.69

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
EP-0357192-B1 PROCESS FOR PREPARING SUBSTITUTED GUANYLTHIOUREAS PFIZER INC. (US) 1992-05-06 EP claimed
US-8158806-B2 DAT1 DEPARTMENT OF BIOTECHNOLOGY (IN) 2012-04-17 US disclosed
US-20090298177-A1 DAT1 DEPARTMENT OF BIOTECHNOLOGY (IN) 2009-12-03 US disclosed
US-20090018341-A1 DAT1 DEPARTMENT OF BIOTECHNOLOGY (IN) 2009-01-15 US disclosed
US-20080132709-A1 Dat1 DEPARTMENT OF BIOTECHNOLOGY (IN) 2008-06-05 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 (3 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-20090298177-A1 DAT1 TUBB1, TUBB6, TUBB ALDH1A1 151/4885TSHR 2198/4885MITF 3124/4885
US-20090018341-A1 DAT1 TUBB1, TUBB6, TUBB ALDH1A1 151/4885TSHR 2198/4885MITF 3124/4885
US-20080132709-A1 Dat1 TUBB1, TUBB6, TUBB ALDH1A1 151/4885TSHR 2198/4885MITF 3124/4885

“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.