SCHEMBL16291369

SCHEMBL16291369

O=c1c2ccccc2nc(SSc2nc3ccccc3c(=O)n2-c2ccccc2)n1-c1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 8/20 0.70
ALDH1A1 P00352 4/20 0.65
PTGS2 P35354 2/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
PDE7B Q9NP56 1/20 0.65
TSHR P16473 1/20 0.62
LMNA P02545 1/20 0.59
TGM2 P21980 1/20 0.59
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56

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
SCHEMBL19487245 0.87 LMNA (0.77) PDE7AALDH1A1PTGS2SMN1; SMN2PDE7B
SCHEMBL18239988 0.83 PDE7A (1.00) PDE7AALDH1A1PTGS2SMN1; SMN2PDE7B
SCHEMBL9671609 0.82 PDE7A (1.00) PDE7AALDH1A1PTGS2SMN1; SMN2PDE7B
SCHEMBL14010913 0.81 TGM2 (0.75) PDE7AALDH1A1PTGS2SMN1; SMN2PDE7B
SCHEMBL18239991 0.79 PDE7A (1.00) PDE7AALDH1A1PTGS2SMN1; SMN2PDE7B
SCHEMBL15864324 0.79 NPC1 (0.59) PDE7AALDH1A1PTGS2SMN1; SMN2PDE7B
SCHEMBL9972171 0.79 LMNA (0.74) PDE7AALDH1A1SMN1; SMN2PDE7BTSHR
SCHEMBL1101917 0.77 LMNA (0.72) PDE7AALDH1A1PTGS2SMN1; SMN2PDE7B
SCHEMBL1101909 0.77 LMNA (0.72) PDE7AALDH1A1PTGS2SMN1; SMN2PDE7B
SCHEMBL9671522 0.77 PDE7A (1.00) PDE7AALDH1A1PTGS2SMN1; SMN2PDE7B

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-10633369-B2 Method of inhibiting DYRK1B 4 SC AG (DE) 2020-04-28 US disclosed
US-20180201606-A1 METHOD OF INHIBITING DYRK1B 4 SC AG (DE) 2018-07-19 US disclosed
US-9951050-B2 Method of inhibiting DYRK1B 4 SC AG (DE) 2018-04-24 US disclosed
US-20140371251-A1 METHOD OF INHIBITING DYRK1B 4SC DISCOVERY GMBH (DE) 2014-12-18 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-10633369-B2 Method of inhibiting DYRK1B SMO, GLI1, GRK2 PDE7A 501/4885ALDH1A1 3401/4885PTGS2 1825/4885
US-20180201606-A1 METHOD OF INHIBITING DYRK1B SMO, GLI1, GRK2 PDE7A 501/4885ALDH1A1 3401/4885PTGS2 1825/4885
US-20140371251-A1 METHOD OF INHIBITING DYRK1B SMO, GLI1, GRK2 PDE7A 501/4885ALDH1A1 3401/4885PTGS2 1825/4885

“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.