SCHEMBL2066680

SCHEMBL2066680

O=C1NC(=S)S/C1=C/c1cc(Br)ccc1N1CCOCC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTP4A3 O75365 6/20 0.60
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
POLB P06746 3/20 0.56
LMNA P02545 3/20 0.56
HPGD P15428 3/20 0.56
PKM P14618 2/20 0.56
GAA P10253 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
CISD1 Q9NZ45 3/20 0.51
MAPT P10636 5/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 2/20 0.51
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44

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
SCHEMBL2066683 1.00 PTP4A3 (0.60) PTP4A3MEN1KMT2APOLBLMNA
SCHEMBL10090252 1.00 PTP4A3 (0.60) PTP4A3MEN1KMT2APOLBLMNA
SCHEMBL2067795 0.90 PTP4A3 (0.64) PTP4A3MEN1KMT2APOLBHPGD
SCHEMBL2067794 0.90 PTP4A3 (0.64) PTP4A3MEN1KMT2APOLBHPGD
SCHEMBL10090259 0.90 PTP4A3 (0.64) PTP4A3MEN1KMT2APOLBHPGD
SCHEMBL2065380 0.88 PTP4A3 (0.62) PTP4A3MEN1KMT2APOLBHPGD
SCHEMBL2065384 0.88 PTP4A3 (0.62) PTP4A3MEN1KMT2APOLBHPGD
SCHEMBL10090258 0.88 PTP4A3 (0.62) PTP4A3MEN1KMT2APOLBHPGD
SCHEMBL10090263 0.86 PTP4A3 (0.60) PTP4A3MEN1KMT2APOLBHPGD
SCHEMBL2066675 0.86 PTP4A3 (0.60) PTP4A3MEN1KMT2APOLBHPGD

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 28/4885MEN1 4202/4885KMT2A 2746/4885

“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.