SCHEMBL13442369

SCHEMBL13442369

CNC(=O)N[C@@H](C)CN1CC(C)(C)OC[C@H]1C(=O)Nc1cc(I)cc2c1[nH]c1cnccc12

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ICOSLG O75144 8/20 0.48
ICOS Q9Y6W8 8/20 0.48
CHUK O15111 11/20 0.39
MEN1 O00255 1/20 0.35
IKBKB O14920 1/20 0.35
PIM1 P11309 1/20 0.35
KMT2A Q03164 1/20 0.35
PIM3 Q86V86 1/20 0.35
IKBKG Q9Y6K9 1/20 0.35
MAPT P10636 1/20 0.30
GSK3B P49841 1/20 0.30

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
SCHEMBL12653122 0.92 ICOSLG (0.59) ICOSLGICOSCHUKMEN1IKBKB
SCHEMBL13408021 0.92 ICOSLG (0.59) ICOSLGICOSCHUKMEN1IKBKB
SCHEMBL13349346 0.92 ICOSLG (0.48) ICOSLGICOSCHUKMEN1IKBKB
SCHEMBL12653362 0.91 ICOSLG (0.45) ICOSLGICOSCHUKMEN1IKBKB
SCHEMBL12653013 0.89 ICOSLG (0.46) ICOSLGICOSCHUKMEN1IKBKB
SCHEMBL13349345 0.89 ICOSLG (0.46) ICOSLGICOSCHUKMEN1IKBKB
SCHEMBL13442558 0.89 ICOSLG (0.46) ICOSLGICOSCHUKMEN1IKBKB
SCHEMBL13349410 0.89 ICOSLG (0.45) ICOSLGICOSCHUKMEN1IKBKB
SCHEMBL13315669 0.86 ICOSLG (0.59) ICOSLGICOSCHUKMEN1IKBKB
SCHEMBL13349318 0.85 ICOSLG (0.53) ICOSLGICOSCHUKMEN1IKBKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100093713-A1 BETA-CARBOLINES USEFUL FOR TREATING INFLAMMATORY DISEASE MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-04-15 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-20100093713-A1 BETA-CARBOLINES USEFUL FOR TREATING INFLAMMATORY DISEASE NFKBIA, NFKB2, IKBKG ICOSLG 2200/4885ICOS 589/4885CHUK 8/4885

“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.