SCHEMBL5233192

SCHEMBL5233192

C/C(=C(/C#N)C(N)=S)N1CCCC(O)C1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 1/20 0.35
LMNA P02545 1/20 0.34
GRM3 Q14832 1/20 0.32
MAPK1 P28482 1/20 0.31
MAPK10 P53779 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
SCHEMBL5233187 1.00 CA12 (0.45) CA12CA1CA2CA9SMN1; SMN2
SCHEMBL5233199 1.00 CA12 (0.45) CA12CA1CA2CA9SMN1; SMN2
SCHEMBL5235168 0.81 GPR119 (0.37) MAPK10
SCHEMBL5235171 0.81 GPR119 (0.37) MAPK10
SCHEMBL5235156 0.81 GPR119 (0.37) MAPK10
SCHEMBL5231490 0.81 ALOX15 (0.36) CA12CA1CA2CA9SMN1; SMN2
SCHEMBL5231481 0.81 ALOX15 (0.36) CA12CA1CA2CA9SMN1; SMN2
SCHEMBL5231498 0.81 ALOX15 (0.36) CA12CA1CA2CA9SMN1; SMN2
SCHEMBL5234684 0.80 PDK1 (0.33) SMN1; SMN2ALDH1A1KMT2AMAPK1
SCHEMBL5236697 0.80 PDK1 (0.33) SMN1; SMN2ALDH1A1KMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070219234-A1 Thienopyridine Derivatives SANKYO COMPANY, LIMITED (JP) 2007-09-20 US disclosed
EP-1764367-A1 THIENOPYRIDINE DERIVATIVES Sankyo Company, Limited (JP) 2007-03-21 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-20070219234-A1 Thienopyridine Derivatives RASGRP1, NRAS, HRH3 CA12 3227/4885CA1 1685/4885CA2 290/4885

“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.