SCHEMBL14182716

SCHEMBL14182716

CC1CCC(C(=O)Nc2ccc3[nH]c(-c4ccc(NC(=O)c5ccccc5)cc4)cc3c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 2/20 0.54
▸ MAOB P27338 2/20 0.54
▸ KCNK3 O14649 1/20 0.48
▸ KCNK9 Q9NPC2 1/20 0.48
▸ SLC2A1 P11166 1/20 0.48
▸ NR2E3 Q9Y5X4 2/20 0.46
▸ JAK2 O60674 2/20 0.46
▸ ITK Q08881 2/20 0.46
▸ NPC1 O15118 3/20 0.45
▸ RAB9A P51151 3/20 0.45
▸ MAPT P10636 2/20 0.45
▸ KMT2A Q03164 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ NAMPT P43490 1/20 0.43
▸ PTPN2 P17706 1/20 0.43
▸ PTPN1 P18031 1/20 0.43
▸ ULK1 O75385 1/20 0.42

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
SCHEMBL14182737 1.00 MAOA (0.54) MAOAMAOBKCNK3KCNK9SLC2A1
SCHEMBL14182846 0.92 SLC2A1 (0.48) MAOAMAOBKCNK3KCNK9SLC2A1
SCHEMBL14182718 0.91 MAOA (0.57) MAOAMAOBSLC2A1NR2E3ITK
SCHEMBL14182725 0.90 MAOA (0.47) MAOAMAOBSLC2A1NR2E3NPC1
SCHEMBL14182712 0.90 ALDH1A1 (0.47) MAOAMAOBSLC2A1NR2E3JAK2
SCHEMBL14182732 0.90 KCNK3 (0.61) MAOAMAOBKCNK3KCNK9SLC2A1
SCHEMBL14182710 0.90 KCNK3 (0.61) MAOAMAOBKCNK3KCNK9SLC2A1
SCHEMBL14182743 0.90 KCNK3 (0.61) MAOAMAOBKCNK3KCNK9SLC2A1
SCHEMBL14182715 0.89 RAB9A (0.50) MAOAMAOBSLC2A1NR2E3ITK
SCHEMBL14182734 0.89 RAB9A (0.50) MAOAMAOBSLC2A1NR2E3ITK

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-7375118-B2 Phenyl-indole compounds for modulating IgE and Inhibiting cellular proliferation AVANIR PHARMACEUTICALS (US) 2008-05-20 — — US disclosed
US-7375118-B2 Phenyl-indole compounds for modulating IgE and Inhibiting cellular proliferation AVANIR PHARMACEUTICALS (US) 2008-05-20 — — US disclosed
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