SCHEMBL15319294

SCHEMBL15319294

CCC1OC(CC(F)F)Cc2c(C)cccc21

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 7/20 0.39
MAOA P21397 1/20 0.33
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 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
SCHEMBL15320625 0.73 ADRA2A (0.44)
Hydrochloric Acid SCHEMBL15321393 0.72 ADRA2A (0.43)
SCHEMBL15319670 0.71 DRD1 (0.49) DRD1MAOAHTR2AHTR2CHTR2B
SCHEMBL15319889 0.70 DRD1 (0.46) DRD1HTR2AHTR2CHTR2B
SCHEMBL16534902 0.65 MAOA (0.42) DRD1MAOA
SCHEMBL13457936 0.63 ACHE (0.38) HTR2AHTR2CHTR2B
SCHEMBL12362687 0.63 ACHE (0.38) HTR2AHTR2CHTR2B
SCHEMBL15320519 0.62 ADRA2A (0.46)
SCHEMBL15321072 0.62 ADRA2A (0.46)
SCHEMBL7621892 0.62 HTR2C (0.35) MAOAHTR2AHTR2CHTR2B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2834233-A1 NEW ALPHA2 ADRENOCEPTOR AGONISTS Orion Corporation (FI) 2015-02-11 EP disclosed
WO-2013150173-A1 NEW ALPHA2 ADRENOCEPTOR AGONISTS ORION CORPORATION (FI) 2013-10-10 WO disclosed