SCHEMBL29264653

SCHEMBL29264653

CCN(CC)c1ccc(C=CC(=O)c2ccc(OC)cc2)c(C)c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TNFRSF1A P19438 1/20 0.56
GABRA3 P34903 1/20 0.53
GABRA2 P47869 1/20 0.53
GABRB2 P47870 1/20 0.53
MAOB P27338 7/20 0.52
ABCG2 Q9UNQ0 1/20 0.51
F3 P13726 1/20 0.50
LMNA P02545 3/20 0.49
MAPT P10636 3/20 0.49
HTT P42858 1/20 0.49
CYP1A1 P04798 1/20 0.49
CYP1B1 Q16678 1/20 0.49
BCHE P06276 1/20 0.49
HPGD P15428 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
MCL1 Q07820 1/20 0.49
MAOA P21397 1/20 0.49

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
SCHEMBL29264641 0.87 MAPT (0.60) MAOBABCG2LMNAMAPTHTT
SCHEMBL29264655 0.86 CHRNA7 (0.52) MAOBLMNAMAPTCYP1A1CYP1B1
SCHEMBL29264664 0.86 MAPT (0.51) TNFRSF1AMAOBLMNAMAPTCYP1A1
SCHEMBL10478008 0.85 MAPT (0.49) LMNAMAPTCYP1A1CYP1B1BCHE
SCHEMBL9803979 0.85 MAPT (0.49) LMNAMAPTCYP1A1CYP1B1BCHE
SCHEMBL30298463 0.85 MAPT (0.49) LMNAMAPTCYP1A1CYP1B1BCHE
SCHEMBL7198201 0.83 TNFRSF1A (0.74) TNFRSF1AGABRA3GABRA2GABRB2MAOB
SCHEMBL11140136 0.81 MAOB (0.73) TNFRSF1AMAOBF3LMNAMAPT
SCHEMBL6231825 0.81 MAOB (0.73) TNFRSF1AMAOBF3LMNAMAPT
SCHEMBL11522608 0.81 MAOB (0.73) TNFRSF1AMAOBF3LMNAMAPT

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-118019645-A Photosensitive composition 阿科玛法国公司 2024-05-10 CN disclosed