SCHEMBL27377484

SCHEMBL27377484

CCOC(=O)[C@]1(O)CC[C@@H](OCc2ccccc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 5/20 0.51
OPRL1 P41146 2/20 0.51
DPP4 P27487 1/20 0.48
EPHX2 P34913 1/20 0.45
SIGMAR1 Q99720 1/20 0.44
KDM4E B2RXH2 2/20 0.43
LMNA P02545 4/20 0.42
POLB P06746 2/20 0.42
PKM P14618 1/20 0.42
MAPT P10636 1/20 0.42
BCHE P06276 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ADAM17 P78536 1/20 0.42
OPRD1 P41143 2/20 0.41
OPRK1 P41145 2/20 0.41
SLC22A1 O15245 1/20 0.41
SLC6A4 P31645 1/20 0.41
ADRA1A P35348 1/20 0.41
KCNH2 Q12809 1/20 0.41
HDAC4 P56524 1/20 0.41

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
SCHEMBL27377447 1.00 OPRM1 (0.51) OPRM1OPRL1DPP4EPHX2SIGMAR1
SCHEMBL31471360 0.83 OPRM1 (0.55) OPRM1OPRL1DPP4EPHX2SIGMAR1
SCHEMBL8536152 0.83 OPRM1 (0.47) OPRM1OPRL1DPP4EPHX2SIGMAR1
SCHEMBL14661822 0.83 OPRM1 (0.47) OPRM1OPRL1DPP4EPHX2SIGMAR1
SCHEMBL5039 0.81 ALDH1A1 (0.51) OPRM1OPRL1DPP4KDM4ELMNA
SCHEMBL1589872 0.81 ALDH1A1 (0.51) OPRM1OPRL1DPP4KDM4ELMNA
SCHEMBL871442 0.80 ADAM17 (0.46) OPRM1OPRL1EPHX2KDM4ELMNA
SCHEMBL15927866 0.78 ADAM17 (0.46) OPRM1OPRL1EPHX2KDM4ELMNA
SCHEMBL17103459 0.78 PKM (0.55) KDM4EPOLBPKMMAPTMEN1
SCHEMBL28404362 0.78 DDB1 (0.50) TSHR

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
WO-2024050016-A1 COMPOSITIONS AND METHODS FOR TARGETED INHIBITION AND DEGRADATION OF PROTEINS IN AN INSECT CELL OERTH BIO LLC (US) 2024-03-07 WO disclosed