SCHEMBL14182811

SCHEMBL14182811

CC1CCCCC1C(=O)CNc1ccc(-c2cc3ccc(NC(=O)C4CCCCC4C)cc3[nH]2)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 3/20 0.41
▸ CNR2 P34972 3/20 0.41
▸ ITK Q08881 5/20 0.40
▸ SLC2A1 P11166 1/20 0.38
▸ GAA P10253 1/20 0.36
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ RAB9A P51151 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ KCNQ2 O43526 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ ROCK1 Q13464 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL14182791 0.94 ITK (0.48) ITKSLC2A1MAOAMAOBRAB9A
SCHEMBL14182806 0.94 ITK (0.44) CNR1CNR2ITKSLC2A1GAA
SCHEMBL14183010 0.90 ITK (0.45) CNR1CNR2ITKSLC2A1GAA
SCHEMBL14182807 0.86 ALDH1A1 (0.41) CNR2ITKRAB9ALMNAALDH1A1
SCHEMBL14182799 0.85 GRM4 (0.40) RAB9AALDH1A1NPC1SMN1; SMN2
SCHEMBL14182810 0.85 RAB9A (0.40) CNR1CNR2ITKSLC2A1RAB9A
SCHEMBL14182996 0.85 ITK (0.52) ITKSLC2A1MAOAMAOBRAB9A
SCHEMBL14183009 0.85 ITK (0.52) ITKSLC2A1MAOAMAOBRAB9A
SCHEMBL14182789 0.82 ITK (0.51) ITKSLC2A1MAOAMAOBRAB9A
SCHEMBL14182788 0.82 ITK (0.51) ITKSLC2A1MAOAMAOBRAB9A

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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