SCHEMBL28002986

SCHEMBL28002986

c1ccc(-c2ccc(C3(c4ccc(-c5ccccc5)c5ccccc45)CCCCO3)c3ccccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.36
HTR2B P41595 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.33
SLC6A4 P31645 3/20 0.32
SLC6A3 Q01959 3/20 0.32
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30
CTRC Q99895 1/20 0.30

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
SCHEMBL28002979 0.82 HTR7 (0.38) HTR7HTR2BSLC6A4SLC6A3
SCHEMBL28817372 0.81 HTR7 (0.37) HTR7HTR2BSLC6A4SLC6A3
SCHEMBL28002993 0.80 HTR7 (0.36) HTR7HTR2BSLC6A4SLC6A3
SCHEMBL27993661 0.71 HTR7 (0.37) HTR7HTR2BSLC6A4SLC6A3MEN1
SCHEMBL10453624 0.70 SLC6A3 (0.46) HTR7HTR2BSLC6A4SLC6A3MEN1
SCHEMBL8666950 0.70 DPP4 (0.41) SMN1; SMN2SLC6A4SLC6A3
SCHEMBL7003423 0.69 SLC6A2 (0.41) SMN1; SMN2SLC6A4SLC6A3
SCHEMBL15908327 0.68 KDM1A (0.45) HTR7HTR2BMEN1POLBKMT2A
SCHEMBL14087464 0.67 HTR7 (0.51) HTR7HTR2BMEN1POLBKMT2A
SCHEMBL28002982 0.67 SLC6A4 (0.35) HTR7HTR2BSMN1; SMN2SLC6A4SLC6A3

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
CN-104292207-A 2,5-difused-ring-substituted naphthyl oxane derivative and preparation method thereof SHANDONG SHENGHUA ELECTRONIC NEW MATERIAL CO LTD 2015-01-21 CN disclosed