SCHEMBL6764407

SCHEMBL6764407

O=C(O)c1cccc(C(O)=CC(=O)c2cn(S(=O)(=O)c3ccccc3)c3ccc(Cl)cc23)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ AKR1C3 P42330 3/20 0.42
▸ AKR1C1 Q04828 2/20 0.42
▸ PLK1 P53350 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ TNF P01375 1/20 0.41
▸ HTR6 P50406 2/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ ACLY P53396 2/20 0.40
▸ PPARG P37231 5/20 0.40
▸ PPARD Q03181 5/20 0.40
▸ PPARA Q07869 5/20 0.40
▸ CMA1 P23946 1/20 0.39
▸ TNFSF11 O14788 1/20 0.39
▸ CPT2 P23786 1/20 0.38
▸ CPT1A P50416 1/20 0.38
▸ CPT1B Q92523 1/20 0.38

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
SCHEMBL6773745 0.89 MEN1 (0.53) LMNASMN1; SMN2PLK1MEN1KMT2A
SCHEMBL7837078 0.84 LMNA (0.42) LMNASMN1; SMN2AKR1C3AKR1C1PLK1
SCHEMBL7135129 0.84 LMNA (0.48) LMNASMN1; SMN2AKR1C3AKR1C1PLK1
SCHEMBL6768534 0.84 LMNA (0.48) LMNASMN1; SMN2AKR1C3AKR1C1PLK1
SCHEMBL6773761 0.83 SMN1; SMN2 (0.46) LMNASMN1; SMN2AKR1C3AKR1C1PLK1
SCHEMBL1466360 0.82 AKR1C3 (0.60) LMNASMN1; SMN2AKR1C3AKR1C1PLK1
SCHEMBL6764600 0.80 LMNA (0.48) LMNASMN1; SMN2AKR1C3AKR1C1PLK1
SCHEMBL6764599 0.80 LMNA (0.48) LMNASMN1; SMN2AKR1C3AKR1C1PLK1
SCHEMBL6769055 0.78 LMNA (0.71) LMNASMN1; SMN2AKR1C3AKR1C1PLK1
SCHEMBL6766808 0.77 MEN1 (0.44) LMNASMN1; SMN2AKR1C3AKR1C1PLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6716605-B2 Indole derivatives having an antiviral activity SHIONOGI & CO., LTD. (JP) 2004-04-06 — — US disclosed
US-20030181499-A1 Indole derivatives having an antiviral activity FUJISHITA TOSHIO (JP) 2003-09-25 — — US disclosed
US-6506787-B2 Aids therapy SHIONOGI & CO., LTD. (JP) 2003-01-14 — — US disclosed
US-20020019434-A1 Indole derivatives having an antiviral activity FUJISHITA TOSHIO (JP) 2002-02-14 — — US disclosed
US-6333323-B1 AS ANTI-HUMAN IMMUNODEFICIENCY VIRUS (HIV) DRUGS SHIONOGI & CO., LTD. (JP) 2001-12-25 — — 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 (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-20020019434-A1 Indole derivatives having an antiviral activity IDO1, IDO2, RCOR1 LMNA 3556/4885SMN1; SMN2 4787/4885AKR1C3 1430/4885
US-20030181499-A1 Indole derivatives having an antiviral activity IDO1, RCOR1, IDO2 LMNA 3448/4885SMN1; SMN2 4797/4885AKR1C3 1567/4885

“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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