SCHEMBL12658114

SCHEMBL12658114

COC(=O)c1[nH]cc(-c2c[nH]c3cc(Cl)c(Cl)cc23)c1-c1c[nH]c2ccc(F)cc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SPR P35270 1/20 0.42
▸ NR4A2 P43354 5/20 0.42
▸ KDM4E B2RXH2 3/20 0.40
▸ PRKAG1 P54619 3/20 0.39
▸ PRKAA1 Q13131 3/20 0.39
▸ PRKAB1 Q9Y478 3/20 0.39
▸ PRKAB2 O43741 2/20 0.39
▸ PRKAA2 P54646 2/20 0.39
▸ PRKAG3 Q9UGI9 2/20 0.39
▸ PRKAG2 Q9UGJ0 2/20 0.39
▸ IGF1R P08069 1/20 0.39
▸ PDGFRB P09619 1/20 0.39
▸ KIT P10721 1/20 0.39
▸ PDGFRA P16234 1/20 0.39
▸ FLT1 P17948 1/20 0.39
▸ FLT4 P35916 1/20 0.39
▸ KDR P35968 1/20 0.39
▸ TEK Q02763 1/20 0.39
▸ NOTUM Q6P988 2/20 0.38
▸ MTNR1A P48039 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
SCHEMBL14188731 0.94 SPR (0.41) SPRNR4A2KDM4EPRKAG1PRKAA1
SCHEMBL14215657 0.92 KDM4E (0.46) SPRNR4A2KDM4EIGF1RPDGFRB
SCHEMBL12658220 0.91 SPR (0.43) SPRNR4A2KDM4EPRKAG1PRKAA1
SCHEMBL14188730 0.90 NR4A2 (0.54) SPRNR4A2KDM4EIGF1RPDGFRB
SCHEMBL12658205 0.90 NR4A2 (0.44) NR4A2PRKAG1PRKAA1PRKAB1PRKAB2
Lynamicin B SCHEMBL12658014 0.89 NR4A2 (0.55) NR4A2KDM4EMTNR1AMTNR1BMEN1
SCHEMBL14188735 0.88 NR4A2 (0.52) NR4A2KDM4EPRKAG1PRKAA1PRKAB1
SCHEMBL12658130 0.85 NR4A2 (0.51) NR4A2KDM4EPRKAG1PRKAA1PRKAB1
Lynamicin A SCHEMBL12658027 0.83 NR4A2 (0.61) NR4A2KDM4EMTNR1AMTNR1BMEN1
SCHEMBL14188729 0.81 KDM4E (0.46) SPRNR4A2KDM4EIGF1RPDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1711486-B1 BIS-INDOLE PYRROLES USEFUL AS ANTIMICROBIAL AGENTS NEREUS PHARMACEUTICALS INC (US) 2011-05-11 — — EP disclosed
US-7375129-B2 Bis-indole pyrroles useful as antimicrobials agents NEREUS PHARMACEUTICALS, INC. (US) 2008-05-20 — — US disclosed
US-7375129-B2 Bis-indole pyrroles useful as antimicrobials agents NEREUS PHARMACEUTICALS, INC. (US) 2008-05-20 — — US disclosed
US-20070149601-A1 Bis-indole pyrroles useful as antimicrobials agents PRIVATE LIFE BIOMED AG (DE) 2007-06-28 — — US disclosed
US-20070149601-A1 Bis-indole pyrroles useful as antimicrobials agents PRIVATE LIFE BIOMED AG (DE) 2007-06-28 — — US disclosed
US-7166634-B2 Bis-indole pyrroles useful as antimicrobials agents NEREUS PHARMACEUTICALS, INC. (US) 2007-01-23 — — US disclosed
US-7166634-B2 Bis-indole pyrroles useful as antimicrobials agents NEREUS PHARMACEUTICALS, INC. (US) 2007-01-23 — — 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-20070149601-A1 Bis-indole pyrroles useful as antimicrobials agents IDO1, IDO2, TPH1 SPR 676/4885NR4A2 4802/4885KDM4E 3060/4885

“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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