SCHEMBL28517675

SCHEMBL28517675

Cc1ccccc1-n1cc(CO)c2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 11/20 0.57
ATP4A P20648 3/20 0.50
ATP4B P51164 3/20 0.50
GPR84 Q9NQS5 1/20 0.40
RORC P51449 1/20 0.39
HPGD P15428 1/20 0.39
ALKBH5 Q6P6C2 1/20 0.39
FTO Q9C0B1 1/20 0.39
HTR1A P08908 1/20 0.38

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
SCHEMBL8170195 0.80 ATP4A (0.48) HTR7ATP4AATP4BALKBH5FTO
SCHEMBL28517674 0.77 ESRRA (0.59) HTR7RORC
Hydrochloric Acid SCHEMBL28233646 0.75 HTR7 (0.61) HTR7HTR1A
SCHEMBL28521811 0.74 HTR7 (0.43) HTR7ATP4AATP4BRORCALKBH5
SCHEMBL28534560 0.74 HTR7 (0.43) HTR7ATP4AATP4BRORCHPGD
SCHEMBL15174383 0.74 RORC (0.53) HTR7RORC
SCHEMBL13714631 0.74 HTR7 (0.46) HTR7
SCHEMBL28827391 0.74 LMNA (0.42) HTR7RORC
SCHEMBL28524081 0.74 IDO1 (0.46) HTR7ATP4AATP4BHPGDALKBH5
SCHEMBL18976935 0.73 ATP4A (0.50) HTR7ATP4AATP4BALKBH5FTO

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-112375104-A Phospholactone indole compound and preparation method thereof 苏州大学 2021-02-19 CN disclosed