SCHEMBL8612808

SCHEMBL8612808

Cc1ccc(Oc2c(C3NC=CCN3)coc2-c2ccccc2)cc1

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 1/20 0.31
▸ PTGS2 P35354 2/20 0.31
▸ PTGS1 P23219 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ NPSR1 Q6W5P4 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
SCHEMBL8612805 0.74 MCHR1 (0.32) MCHR1MEN1ALDH1A1LMNAMAPT
Biphenyl SCHEMBL312988 0.60 HTT (0.59) MEN1ALDH1A1LMNAMAPTHTT
SCHEMBL16361074 0.59 HTT (0.57) MEN1ALDH1A1LMNAMAPTHTT
SCHEMBL2058591 0.59 HTT (0.57) MEN1ALDH1A1LMNAMAPTHTT
SCHEMBL537243 0.59 HTT (0.57) MEN1ALDH1A1LMNAMAPTHTT
SCHEMBL425356 0.56 HTT (0.69) MEN1ALDH1A1LMNAMAPTHTT
SCHEMBL17081753 0.56 HTT (0.69) MEN1ALDH1A1LMNAMAPTHTT
SCHEMBL12355 0.56 HTT (0.69) MEN1ALDH1A1LMNAMAPTHTT
SCHEMBL3874015 0.56 TEAD4 (0.59) MEN1ALDH1A1LMNAMAPTHTT
SCHEMBL1096473 0.56 NCOA1 (0.68) PTGS2MEN1ALDH1A1LMNAMAPT

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
US-5723288-A Method of fluorescent detection of nucleic acids and cytoskeleton elements using bis-dicationic aryl furans, and kits useful therefor THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1998-03-03 — — US disclosed
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