SCHEMBL9568033

SCHEMBL9568033

CNc1ccccc1-c1[c]ccc(OC)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.37
MAOA P21397 1/20 0.37
GPR3 P46089 1/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2A6 P11509 1/20 0.34
GAA P10253 5/20 0.33
ALDH1A1 P00352 5/20 0.33
KDM4E B2RXH2 4/20 0.33
MAPT P10636 4/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
POLB P06746 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
ATM Q13315 1/20 0.33
ABL1 P00519 1/20 0.33
ABCB1 P08183 1/20 0.33
BCR P11274 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL8125196 0.79 CYP1A2 (0.40) ACHEGPR3KMT2AMEN1CYP1A2
SCHEMBL8528792 0.79 ALDH1A1 (0.44) KMT2AMEN1CYP1A2CYP2A6ALDH1A1
SCHEMBL8123605 0.78 RAB9A (0.46) GPR3KMT2AMEN1CYP1A2CYP2A6
SCHEMBL5670544 0.78 MEN1 (0.40) GPR3KMT2AMEN1CYP1A2CYP2A6
SCHEMBL9764779 0.77 ABCB1 (0.41) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL15066961 0.75 ALDH1A1 (0.41) ACHEKMT2AMEN1CYP1A2CYP2A6
SCHEMBL7067601 0.75 CYP1A2 (0.42) KMT2AMEN1CYP1A2CYP2A6ALDH1A1
SCHEMBL10437518 0.75 GPR3 (0.35) ACHEGPR3KMT2AMEN1CYP1A2
SCHEMBL26072863 0.74 MAPT (0.39) ACHEMAOAKMT2AMEN1ALDH1A1
SCHEMBL15404637 0.74 CYP24A1 (0.41) KMT2AMEN1CYP1A2GAAMAPT

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-0550161-A1 Single layer photoreceptor XEROX CORPORATION (US) 1993-07-07 EP disclosed