SCHEMBL12658267

SCHEMBL12658267

COC(=O)c1[nH]cc(-c2c[nH]c3cc(Cl)c(Cl)cc23)c1-c1c[nH]c2ncccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP2K1 Q02750 1/20 0.48
▸ PDPK1 O15530 1/20 0.43
▸ TGFBR1 P36897 1/20 0.43
▸ IKBKE Q14164 1/20 0.43
▸ CDC7 O00311 9/20 0.43
▸ CLK4 Q9HAZ1 6/20 0.43
▸ DYRK1A Q13627 6/20 0.43
▸ PRKACA P17612 5/20 0.43
▸ CDK8 P49336 5/20 0.43
▸ DYRK1B Q9Y463 5/20 0.43
▸ ROCK2 O75116 5/20 0.43
▸ HIPK2 Q9H2X6 4/20 0.43
▸ STK17A Q9UEE5 4/20 0.43
▸ MAP4K4 O95819 3/20 0.43
▸ CLK2 P49760 3/20 0.43
▸ CDK5 Q00535 3/20 0.43
▸ CDK2 P24941 3/20 0.43
▸ CDK7 P50613 3/20 0.43
▸ CDK9 P50750 3/20 0.43
▸ MELK Q14680 2/20 0.43

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
SCHEMBL12658205 0.87 NR4A2 (0.44) —
Lynamicin B SCHEMBL12658014 0.82 NR4A2 (0.55) —
SCHEMBL14188735 0.81 NR4A2 (0.52) —
SCHEMBL12658114 0.80 SPR (0.42) FLT1
SCHEMBL12658125 0.80 NR4A2 (0.50) MAP2K1CDC7CLK4DYRK1APRKACA
SCHEMBL12658224 0.76 PIM1 (0.55) MAP2K1PDPK1TGFBR1IKBKECDC7
SCHEMBL12658265 0.76 MAP2K1 (0.46) MAP2K1CDC7CLK4DYRK1APRKACA
Lynamicin A SCHEMBL12658027 0.76 NR4A2 (0.61) —
SCHEMBL12658127 0.75 NR4A2 (0.57) GSK3B
SCHEMBL14188731 0.74 SPR (0.41) FLT1

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 MAP2K1 4190/4885PDPK1 660/4885TGFBR1 4613/4885

“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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