SCHEMBL8686278

SCHEMBL8686278

COC(=O)[C@H]1CN(Cc2ccccc2)C[C@@H]1c1ccccc1OC

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
CHRM4 P08173 1/20 0.47
SIGMAR1 Q99720 3/20 0.47
ALDH1A1 P00352 1/20 0.46
HSD11B1 P28845 1/20 0.44
SLC6A12 P48065 1/20 0.44
MAPT P10636 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
DRD2 P14416 1/20 0.44
DRD3 P35462 1/20 0.44

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
SCHEMBL8686279 1.00 MEN1 (0.52) MEN1KMT2ACHRM4SIGMAR1ALDH1A1
SCHEMBL8690461 0.91 SLC6A12 (0.51) MEN1KMT2ASIGMAR1ALDH1A1SLC6A12
SCHEMBL8690463 0.91 SLC6A12 (0.51) MEN1KMT2ASIGMAR1ALDH1A1SLC6A12
SCHEMBL8314184 0.90 MEN1 (0.54) MEN1KMT2ACHRM4SIGMAR1ALDH1A1
SCHEMBL8782084 0.90 MEN1 (0.54) MEN1KMT2ACHRM4SIGMAR1ALDH1A1
SCHEMBL8314188 0.90 MEN1 (0.54) MEN1KMT2ACHRM4SIGMAR1ALDH1A1
SCHEMBL8782076 0.90 MEN1 (0.54) MEN1KMT2ACHRM4SIGMAR1ALDH1A1
SCHEMBL29960364 0.90 MEN1 (0.49) MEN1KMT2ASIGMAR1ALDH1A1MAPK1
SCHEMBL8685708 0.89 DRD2 (0.53) MEN1KMT2ASIGMAR1ALDH1A1MAPK1
SCHEMBL8687558 0.89 DRD2 (0.53) MEN1KMT2ASIGMAR1ALDH1A1MAPT

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
US-5723484-A Benzopyran compounds as 5-HT2C receptor antagonists ADIR ET COMPAGNIE (FR) 1998-03-03 US disclosed