SCHEMBL2066084

SCHEMBL2066084

O=C1NC(=S)S/C1=C/c1cc(Br)ccc1N1CCN(Cc2ccccc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PTP4A3 O75365 7/20 0.60
▸ PIK3CG P48736 1/20 0.48
▸ PTPN1 P18031 1/20 0.47
▸ CISD1 Q9NZ45 3/20 0.47
▸ PIM1 P11309 1/20 0.46
▸ MEN1 O00255 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ ADAMTS5 Q9UNA0 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ NAT1 P18440 1/20 0.44
▸ EPHX1 P07099 1/20 0.44
▸ TRPC5 Q9UL62 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
SCHEMBL10090257 1.00 PTP4A3 (0.60) PTP4A3PIK3CGPTPN1CISD1PIM1
SCHEMBL2066085 1.00 PTP4A3 (0.60) PTP4A3PIK3CGPTPN1CISD1PIM1
SCHEMBL2066107 0.88 PIM1 (0.54) PTP4A3PIK3CGPIM1CA2NAT1
SCHEMBL10090251 0.88 PIM1 (0.54) PTP4A3PIK3CGPIM1CA2NAT1
SCHEMBL2066104 0.88 PIM1 (0.54) PTP4A3PIK3CGPIM1CA2NAT1
SCHEMBL2065864 0.84 PTP4A3 (0.71) PTP4A3PTPN1CISD1MEN1KMT2A
SCHEMBL10090302 0.84 PTP4A3 (0.71) PTP4A3PTPN1CISD1MEN1KMT2A
SCHEMBL2067795 0.83 PTP4A3 (0.64) PTP4A3CISD1PIM1MEN1NPC1
SCHEMBL2067794 0.83 PTP4A3 (0.64) PTP4A3CISD1PIM1MEN1NPC1
SCHEMBL10090259 0.83 PTP4A3 (0.64) PTP4A3CISD1PIM1MEN1NPC1

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 28/4885PIK3CG 168/4885PTPN1 26/4885

“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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