SCHEMBL2065103

SCHEMBL2065103

CCNC(=O)N(C)CCOc1ccc(Br)cc1C=C1SC(=S)NC1=O

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTP4A3 O75365 7/20 0.57
PDE4B Q07343 3/20 0.45
PDE3A Q14432 3/20 0.45
GSK3B P49841 2/20 0.45
PTPN1 P18031 2/20 0.45
CISD1 Q9NZ45 2/20 0.44
MAOB P27338 1/20 0.44
DYRK1A Q13627 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
PIM1 P11309 1/20 0.43
PIM3 Q86V86 1/20 0.43
DYRK2 Q92630 1/20 0.43
PIM2 Q9P1W9 1/20 0.43

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
SCHEMBL10090186 1.00 PTP4A3 (0.57) PTP4A3PDE4BPDE3AGSK3BPTPN1
SCHEMBL14463945 0.90 GSK3B (0.47) PTP4A3PDE4BPDE3AGSK3BCISD1
SCHEMBL14464061 0.89 PDE4B (0.45) PTP4A3PDE4BPDE3AGSK3BCISD1
SCHEMBL10090319 0.89 PTP4A3 (0.61) PTP4A3PDE4BPDE3AGSK3BPTPN1
SCHEMBL2065355 0.89 PTP4A3 (0.61) PTP4A3PDE4BPDE3AGSK3BPTPN1
SCHEMBL14464062 0.89 PTP4A3 (0.64) PTP4A3PDE4BPDE3AGSK3BPTPN1
SCHEMBL14464067 0.88 PTP4A3 (0.60) PTP4A3PDE4BPDE3AGSK3BPTPN1
SCHEMBL2067673 0.88 PTP4A3 (0.61) PTP4A3GSK3BPTPN1CISD1MEN1
SCHEMBL10090316 0.88 PTP4A3 (0.61) PTP4A3GSK3BPTPN1CISD1MEN1
SCHEMBL10090317 0.85 PTP4A3 (0.51) PTP4A3GSK3BCISD1MAOBDYRK1A

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-8148541-B2 Rhodanine derivatives, a process for the preparation thereof and pharmaceutical composition containing the same KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2012-04-03 US claimed
US-20090042872-A1 Rhodanine Derivatives, a Process for the Preparation Thereof and Pharmaceutical Composition Containing the Same KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2009-02-12 US claimed
US-8148541-B2 Rhodanine derivatives, a process for the preparation thereof and pharmaceutical composition containing the same KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2012-04-03 US disclosed
US-20090042872-A1 Rhodanine Derivatives, a Process for the Preparation Thereof and Pharmaceutical Composition Containing the Same KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2009-02-12 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 (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-20090042872-A1 Rhodanine Derivatives, a Process for the Preparation Thereof and Pharmaceutical Composition Containing the Same PTPRR, PTPRG, PTPRS PTP4A3 28/4885PDE4B 720/4885PDE3A 579/4885

“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.