SCHEMBL2067503

SCHEMBL2067503

O=C1NC(=S)SC1=Cc1cc(Br)ccc1OCCN1CCOCC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTP4A3 O75365 6/20 0.61
▸ HPGD P15428 2/20 0.53
▸ ALDH1A1 P00352 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ KDR P35968 1/20 0.49
▸ GSK3B P49841 2/20 0.48
▸ PTPN1 P18031 2/20 0.48
▸ HRH3 Q9Y5N1 1/20 0.46
▸ GAA P10253 2/20 0.46
▸ MGAM O43451 1/20 0.46
▸ SI P14410 1/20 0.46
▸ MGAM2 Q2M2H8 1/20 0.46
▸ CISD1 Q9NZ45 1/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ PKM P14618 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL2067501 1.00 PTP4A3 (0.61) PTP4A3HPGDALDH1A1MAPTHTT
SCHEMBL10090241 1.00 PTP4A3 (0.61) PTP4A3HPGDALDH1A1MAPTHTT
SCHEMBL10090303 0.91 PTP4A3 (0.64) PTP4A3HPGDGSK3BPTPN1HRH3
SCHEMBL2065979 0.91 PTP4A3 (0.64) PTP4A3HPGDGSK3BPTPN1HRH3
SCHEMBL2065975 0.91 PTP4A3 (0.64) PTP4A3HPGDGSK3BPTPN1HRH3
SCHEMBL2065371 0.86 PTP4A3 (0.63) PTP4A3ALDH1A1GSK3BPTPN1HRH3
SCHEMBL2065372 0.86 PTP4A3 (0.63) PTP4A3ALDH1A1GSK3BPTPN1HRH3
SCHEMBL10090309 0.86 PTP4A3 (0.63) PTP4A3ALDH1A1GSK3BPTPN1HRH3
SCHEMBL2065864 0.85 PTP4A3 (0.71) PTP4A3GSK3BPTPN1GAAMGAM
SCHEMBL10090302 0.85 PTP4A3 (0.71) PTP4A3GSK3BPTPN1GAAMGAM

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 28/4885HPGD 2629/4885ALDH1A1 2660/4885

“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.

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