SCHEMBL1800865

SCHEMBL1800865

CC(C)(C)OC(=O)NC1CCCC1C(=O)Nc1cc(Cl)cc2c1[nH]c1cnccc12

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CHUK O15111 16/20 0.59
▸ ICOSLG O75144 9/20 0.53
▸ ICOS Q9Y6W8 9/20 0.53
▸ MEN1 O00255 1/20 0.50
▸ IKBKB O14920 1/20 0.50
▸ PIM1 P11309 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ PIM3 Q86V86 1/20 0.50
▸ IKBKG Q9Y6K9 1/20 0.50
▸ CCR1 P32246 1/20 0.40

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
SCHEMBL1794961 0.81 CHUK (0.62) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL1797661 0.80 CHUK (0.62) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL12619326 0.80 CHUK (0.62) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL13376960 0.78 CHUK (0.69) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL14253042 0.76 CHUK (1.00) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL13377026 0.75 CHUK (0.77) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL5764362 0.74 CHUK (0.54) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL5764367 0.74 CHUK (0.54) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL1803665 0.74 ICOSLG (0.54) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL1803664 0.74 ICOSLG (0.54) CHUKICOSLGICOSMEN1IKBKB

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-7951801-B2 For therapy of inflammatory disease and cancer MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-05-31 — — US disclosed
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