SCHEMBL3138747

SCHEMBL3138747

C1=NCCN1C1CCNCC1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
PKM P14618 1/20 0.34
ALOX15 P16050 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32

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
SCHEMBL26546933 0.88 HTR6 (0.33)
SCHEMBL9044557 0.78
SCHEMBL5376368 0.78
SCHEMBL14862826 0.72 HTR6 (0.37) HTR2AHTR2C
SCHEMBL2670282 0.70
SCHEMBL7490307 0.70 CTDSP1 (0.32)
SCHEMBL13813915 0.67 L3MBTL3 (0.35) MEN1ALDH1A1MAPTPKMALOX15
SCHEMBL18518972 0.66 SMN1; SMN2 (0.43) ALDH1A1MAPT
SCHEMBL27729342 0.65 HTR2C (0.33) MEN1ALDH1A1MAPTPKMALOX15
SCHEMBL2265420 0.64 HTR2C (0.33) MEN1ALDH1A1MAPTPKMALOX15

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
EP-2142528-B1 1-(1-BENZYLPIPERIDIN-4-YL)BENZIMIDAZ0LE -5-CARBOXYLIC ACID DERIVATIVES FOR THE TREATMENT OF DIABETES MELLITUS HOFFMANN LA ROCHE (CH) 2010-07-07 EP disclosed