SCHEMBL4852579

SCHEMBL4852579

[NH]CCOc1ccc(C=C2SC(=O)NC2=O)cc1

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 2/20 0.74
PIM2 Q9P1W9 2/20 0.74
HPGD P15428 12/20 0.67
CISD1 Q9NZ45 2/20 0.67
MAOA P21397 1/20 0.64
MAOB P27338 1/20 0.64
PTGS2 P35354 1/20 0.64
GPR35 Q9HC97 1/20 0.64
HRH3 Q9Y5N1 1/20 0.63
PTPN1 P18031 1/20 0.63

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
SCHEMBL4852574 1.00 PIM1 (0.74) PIM1PIM2HPGDCISD1MAOA
SCHEMBL9570682 0.88 PIM1 (0.78) PIM1PIM2HPGDCISD1MAOA
SCHEMBL9570687 0.88 PIM1 (0.78) PIM1PIM2HPGDCISD1MAOA
SCHEMBL2544389 0.87 PIM1 (0.76) PIM1PIM2HPGDCISD1MAOA
SCHEMBL2544390 0.87 PIM1 (0.76) PIM1PIM2HPGDCISD1MAOA
SCHEMBL2544373 0.85 PIM1 (1.00) PIM1PIM2HPGDCISD1MAOA
SCHEMBL10272939 0.85 PIM1 (0.74) PIM1PIM2HPGDCISD1MAOA
SCHEMBL2544367 0.85 PIM1 (1.00) PIM1PIM2HPGDCISD1MAOA
SCHEMBL9212605 0.85 PIM1 (0.74) PIM1PIM2HPGDCISD1MAOA
SCHEMBL9803954 0.85 PIM1 (0.74) PIM1PIM2HPGDCISD1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050159463-A1 Indole derivatives NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2005-07-21 US claimed
EP-1189583-B1 INDOLE DERIVATIVES NEURIM PHARMA 1991 (IL) 2005-07-20 EP claimed
US-7355054-B2 Indole derivatives NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2008-04-08 US disclosed
US-20050159463-A1 Indole derivatives NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2005-07-21 US disclosed
EP-1189583-B1 INDOLE DERIVATIVES NEURIM PHARMA 1991 (IL) 2005-07-20 EP disclosed
US-6858642-B1 Indole derivatives NEURIM PHARMACEUTICALS (1991) LTD. (IL) 2005-02-22 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-20050159463-A1 Indole derivatives IDO1, IDO2, H1-0 PIM1 3614/4885PIM2 3451/4885HPGD 1579/4885

“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.