SCHEMBL6821059

SCHEMBL6821059

Oc1c(-c2ccccc2)n(Cc2ccccc2)c2ccc(F)cc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
HK1 P19367 1/20 0.48
HTT P42858 1/20 0.48
HKDC1 Q2TB90 1/20 0.48
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 2/20 0.46
HSD17B10 Q99714 1/20 0.46
GAA P10253 1/20 0.46
SRC P12931 1/20 0.44
PTGDR2 Q9Y5Y4 4/20 0.44
AKR1B10 O60218 1/20 0.44
AKR1A1 P14550 1/20 0.44
AKR1B1 P15121 1/20 0.44
HDAC1 Q13547 2/20 0.43
HDAC8 Q9BY41 2/20 0.43
HDAC6 Q9UBN7 2/20 0.43
CD74 P04233 1/20 0.43
MIF P14174 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43

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
SCHEMBL6823487 0.87 MDM2 (0.48) MAPTKDM4EHSD17B10MEN1KMT2A
SCHEMBL6918963 0.84 KDR (0.50) MAPTALDH1A1KDM4EHSD17B10SRC
SCHEMBL6821169 0.83 KMT2A (0.52) MAPTHTTALDH1A1KDM4EGAA
SCHEMBL6920117 0.83 CA12 (0.48) MAPTALDH1A1KDM4EGAASRC
SCHEMBL6820233 0.82 CYP19A1 (0.59) MAPTHTTALDH1A1KDM4EGAA
SCHEMBL6821058 0.80 PLA2G2A (0.57) MAPTKMT2ANTRK1
SCHEMBL6820929 0.76 KDR (0.46) MAPTHTTALDH1A1KDM4EHSD17B10
SCHEMBL6923669 0.74 SRC (0.50) MAPTHK1HTTHKDC1ALDH1A1
SCHEMBL28107204 0.73 CYP11B2 (0.59) MAPTHK1HTTHKDC1ALDH1A1
SCHEMBL10067377 0.72 MAPT (0.57) MAPTHK1HTTHKDC1ALDH1A1

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
WO-2004048331-A1 N-ARYLALKYL-3-AMINOALKOXYINDOLES AND THEIR USE AS 5-HT LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2004-06-10 WO disclosed