SCHEMBL7557609

SCHEMBL7557609

Cc1cccc(/C=C2\SC(=S)NC2=O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAT1 P18440 5/20 1.00
PIM1 P11309 2/20 0.74
PIM2 Q9P1W9 1/20 0.74
GSK3B P49841 2/20 0.73
CISD1 Q9NZ45 2/20 0.70
ADAMTS5 Q9UNA0 2/20 0.69
CA2 P00918 1/20 0.68
EPHX1 P07099 1/20 0.68
CRHBP P24387 1/20 0.64
CRHR2 Q13324 1/20 0.64
MMP3 P08254 1/20 0.64
MMP13 P45452 1/20 0.64
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
RAB9A P51151 1/20 0.62
MYC P01106 1/20 0.59
MAX P61244 1/20 0.59
NPC1 O15118 1/20 0.59
ALDH1A1 P00352 1/20 0.59
LMNA P02545 1/20 0.59

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
SCHEMBL7557614 1.00 NAT1 (1.00) NAT1PIM1PIM2GSK3BCISD1
SCHEMBL30250053 0.85 NAT1 (0.74) NAT1PIM1PIM2GSK3BCISD1
SCHEMBL8166386 0.85 NAT1 (0.74) NAT1PIM1PIM2GSK3BCISD1
SCHEMBL8166383 0.85 NAT1 (0.74) NAT1PIM1PIM2GSK3BCISD1
SCHEMBL2539679 0.85 PIM1 (1.00) NAT1PIM1PIM2GSK3BCISD1
SCHEMBL2539680 0.85 PIM1 (1.00) NAT1PIM1PIM2GSK3BCISD1
SCHEMBL2539676 0.85 PIM1 (1.00) NAT1PIM1PIM2GSK3BCISD1
SCHEMBL16709395 0.84 NAT1 (0.71) NAT1PIM1PIM2GSK3BCISD1
SCHEMBL8312154 0.84 PIM1 (0.73) NAT1PIM1PIM2CISD1ADAMTS5
SCHEMBL8312151 0.84 PIM1 (0.73) NAT1PIM1PIM2CISD1ADAMTS5

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002062337-A1 THIAZOLIDINEDIONES SMITHKLINE BEECHAM CORPORATION (US) 2002-08-15 WO claimed
EP-2541329-A1 CHARGE CONTROLLING AGENT AND TONER USING SAME Hodogaya Chemical Co., Ltd. (JP) 2013-01-02 EP disclosed
US-20120315576-A1 CHARGE CONTROLLING AGENT AND TONER USING SAME HODOGAYA CHEMICAL CO., LTD. (JP) 2012-12-13 US disclosed
US-20120315576-A1 CHARGE CONTROLLING AGENT AND TONER USING SAME HODOGAYA CHEMICAL CO., LTD. (JP) 2012-12-13 US disclosed
US-20090204336-A1 PDZ-Domain Modulators FORSCHUNGSVERBUND BERLIN E. V. (DE) 2009-08-13 US disclosed
WO-2002062337-A1 THIAZOLIDINEDIONES SMITHKLINE BEECHAM CORPORATION (US) 2002-08-15 WO disclosed
EP-0915090-A1 Compounds useful as hypoglycemic agents and for treating Alzheimer's disease ELI LILLY AND COMPANY (US) 1999-05-12 EP disclosed
US-5716975-A NONTOXIC RHODANINE DERIVATIVES; ANTIDIABETIC AGENTS, CATHEPSIN D INHIBITORS, B-AMYLOID PROTEIN REDUCTION ELI LILLY AND COMPANY (US) 1998-02-10 US disclosed
US-5661168-A ADMINISTERING RHODANINE DERIVATIVES TO CONTROL DIABETES ELI LILLY AND COMPANY (US) 1997-08-26 US disclosed
US-5523314-A RHODANINE DERIVATIVES ELI LILLY AND COMPANY (US) 1996-06-04 US disclosed
EP-0587377-A2 Thiazolidinone derivatives as hypoglycemic agents and for treating Alzheimer's disease ELI LILLY AND COMPANY (US) 1994-03-16 EP 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 (2 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-20090204336-A1 PDZ-Domain Modulators PDLIM5, DVL1, PSD NAT1 4324/4885PIM1 1210/4885PIM2 913/4885
US-20120315576-A1 CHARGE CONTROLLING AGENT AND TONER USING SAME NPY1R, HCRTR1, CCKAR NAT1 1604/4885PIM1 3705/4885PIM2 4123/4885

“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.