SCHEMBL14253052

SCHEMBL14253052

N#Cc1ccc(C(=O)Nc2cc(Cl)cc3c2[nH]c2cnccc23)cc1

nearest known ligand 0.78

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CHUK O15111 15/20 0.78
▸ ICOSLG O75144 10/20 0.78
▸ ICOS Q9Y6W8 10/20 0.78
▸ MEN1 O00255 1/20 0.71
▸ IKBKB O14920 1/20 0.71
▸ PIM1 P11309 1/20 0.71
▸ KMT2A Q03164 1/20 0.71
▸ PIM3 Q86V86 1/20 0.71
▸ IKBKG Q9Y6K9 1/20 0.71
▸ CYP11B1 P15538 1/20 0.46
▸ CYP11B2 P19099 1/20 0.46

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
SCHEMBL13376959 0.89 CHUK (0.89) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL13377059 0.89 CHUK (0.74) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL13377038 0.88 CHUK (1.00) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL14253005 0.86 CHUK (0.83) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL14253078 0.86 CHUK (0.83) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL14253037 0.86 CHUK (1.00) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL14253053 0.84 CHUK (0.84) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL14253041 0.84 CHUK (1.00) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL2768947 0.83 CHUK (0.78) CHUKICOSLGICOSMEN1IKBKB
SCHEMBL2768231 0.83 CHUK (0.78) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7348336-B2 Substituted β-carbolines SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-03-25 — — US disclosed
US-7348336-B2 Substituted β-carbolines SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-03-25 — — US disclosed
Send feedback