SCHEMBL10090318

SCHEMBL10090318

CCNC(=O)N(C)CCCc1ccc(Br)cc1/C=C1\SC(=S)NC1=O

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PTP4A3 O75365 5/20 0.53
▸ CISD1 Q9NZ45 4/20 0.42
▸ GSK3B P49841 1/20 0.42
▸ CRHBP P24387 2/20 0.41
▸ CRHR2 Q13324 2/20 0.41
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ MYC P01106 1/20 0.39
▸ NAT1 P18440 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ GPR35 Q9HC97 1/20 0.39

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
SCHEMBL14464064 0.87 PTP4A3 (0.51) PTP4A3CISD1GSK3BCRHBPCRHR2
SCHEMBL2065103 0.85 PTP4A3 (0.57) PTP4A3CISD1GSK3BMEN1KMT2A
SCHEMBL10090186 0.85 PTP4A3 (0.57) PTP4A3CISD1GSK3BMEN1KMT2A
SCHEMBL12892067 0.82 PTP4A3 (0.65) PTP4A3CISD1CRHBPCRHR2MEN1
SCHEMBL14463945 0.75 GSK3B (0.47) PTP4A3CISD1GSK3BMEN1KMT2A
SCHEMBL14464061 0.74 PDE4B (0.45) PTP4A3CISD1GSK3BMEN1KMT2A
SCHEMBL2067673 0.73 PTP4A3 (0.61) PTP4A3CISD1GSK3BMEN1KMT2A
SCHEMBL10090316 0.73 PTP4A3 (0.61) PTP4A3CISD1GSK3BMEN1KMT2A
SCHEMBL14464062 0.73 PTP4A3 (0.64) PTP4A3CISD1GSK3BMEN1KMT2A
SCHEMBL2065355 0.73 PTP4A3 (0.61) PTP4A3CISD1GSK3B

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 disclosed
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
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 28/4885CISD1 4740/4885GSK3B 390/4885

“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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