SCHEMBL6661388

SCHEMBL6661388

COP(=O)(OC)[C@@H](CCCCN)C(c1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.43
HTR2A P28223 1/20 0.43
SLC7A5 Q01650 9/20 0.40
GAA P10253 1/20 0.37
ALDH1A1 P00352 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
LAP3 P28838 1/20 0.35

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
SCHEMBL6661785 0.95 HRH1 (0.49) HRH1HTR2ASLC7A5GAAALDH1A1
SCHEMBL6664240 0.89 HRH1 (0.46) HRH1HTR2AGAAALDH1A1SMN1; SMN2
SCHEMBL6665751 0.82 TAAR1 (0.42) HTR2AGAAALDH1A1SMN1; SMN2POLB
SCHEMBL8733506 0.80 HRH1 (0.44) HRH1HTR2ASLC7A5POLB
SCHEMBL8733520 0.80 HRH1 (0.44) HRH1HTR2ASLC7A5POLB
SCHEMBL6662402 0.79 TAAR1 (0.41) HTR2AGAAALDH1A1SMN1; SMN2POLB
SCHEMBL6661372 0.76 HRH1 (0.52) HRH1HTR2APOLBLAP3
SCHEMBL6661377 0.76 HRH1 (0.52) HRH1HTR2APOLBLAP3
SCHEMBL6663343 0.71 TAAR1 (0.42) HTR2AGAAALDH1A1SMN1; SMN2POLB
SCHEMBL7540487 0.70 TAAR1 (0.44) HTR2AGAAALDH1A1SMN1; SMN2POLB

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-0877028-B1 PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE 1-AMINOPHOSPHONIC ACID DERIVATIVES AND NOVEL PHOSPHONATE COMPOUNDS HOKKO CHEM IND CO (JP) 2004-08-25 EP disclosed