SCHEMBL6689958

SCHEMBL6689958

C#CCN(C)C(=O)C1=Cc2ccccc2Oc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
DRD2 P14416 4/20 0.36
DRD4 P21917 4/20 0.36
MAOA P21397 2/20 0.36
MAOB P27338 2/20 0.36
ALOX5 P09917 1/20 0.36
GPR84 Q9NQS5 1/20 0.35
TSPO P30536 1/20 0.33
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
CHRM2 P08172 2/20 0.32
CHRM4 P08173 2/20 0.32
CHRM5 P08912 2/20 0.32
CHRM1 P11229 2/20 0.32
CHRM3 P20309 2/20 0.32
P2RX4 Q99571 1/20 0.31

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
SCHEMBL5810707 0.75 MAOA (0.49) LMNADRD2DRD4MAOAMAOB
Omigapil SCHEMBL29377962 0.73 PYCR1 (0.45) LMNADRD2DRD4MAOAMAOB
Omigapil SCHEMBL333032 0.73 PYCR1 (0.45) LMNADRD2DRD4MAOAMAOB
Omigapil SCHEMBL29369408 0.72 PYCR1 (0.40) LMNADRD2DRD4MAOAMAOB
Omigapil SCHEMBL978230 0.72 PYCR1 (0.40) LMNADRD2DRD4MAOAMAOB
Omigapil SCHEMBL5953610 0.72 PYCR1 (0.40) LMNADRD2DRD4MAOAMAOB
Omigapil SCHEMBL5953608 0.72 PYCR1 (0.40) LMNADRD2DRD4MAOAMAOB
Omigapil SCHEMBL978229 0.72 PYCR1 (0.40) LMNADRD2DRD4MAOAMAOB
SCHEMBL4043208 0.72 LMNA (0.70) LMNADRD2DRD4MAOAMAOB
SCHEMBL4038858 0.72 LMNA (0.54) LMNADRD2DRD4ALOX5GPR84

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-2004039773-A2 COUMPOUNDS MODULATING THE ACTIVITY OF GAPDH AND/OR IAMT NORDIC BIOSCIENCE A/S (DK) 2004-05-13 WO disclosed