SCHEMBL23280449

SCHEMBL23280449

CCC(C)C1Cc2ccccc2CN1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PNMT P11086 6/20 0.59
ADRA2A P08913 2/20 0.44
ADRA2B P18089 2/20 0.44
ADRA2C P18825 2/20 0.44
PRCP P42785 1/20 0.43
SMYD3 Q9H7B4 1/20 0.38
PRMT5 O14744 2/20 0.38
WDR77 Q9BQA1 2/20 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
SCHEMBL21794344 0.87 PNMT (0.56) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL21510095 0.85 PNMT (0.57) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL31158806 0.82 PNMT (0.67) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL13416396 0.82 PNMT (0.67) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL31158866 0.82 PNMT (0.67) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL12741563 0.82 PNMT (0.67) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL19853263 0.79 PNMT (0.62) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL13181686 0.79 PNMT (0.62) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL20759206 0.79 PNMT (0.54) PNMTADRA2AADRA2BADRA2CPRCP
SCHEMBL24420061 0.78 MEN1 (0.48) PNMT

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-3189041-B1 TETRAHYDROISOQUINOLINE DERIVED PRMT5-INHIBITORS CTXT PTY LTD (AU) 2021-04-28 EP disclosed