SCHEMBL29613176

SCHEMBL29613176

COCCCOc1cc2c(cc1Cl)C=NC1C2CCC1(C)C

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.31
HTR2B P41595 1/20 0.31
DHFR P00374 1/20 0.30
POLB P06746 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL19270687 1.00 HTR2C (0.31) HTR2CHTR2BDHFRPOLBL3MBTL1
SCHEMBL19275326 1.00 HTR2C (0.31) HTR2CHTR2BDHFRPOLBL3MBTL1
SCHEMBL19270688 1.00 HTR2C (0.31) HTR2CHTR2BDHFRPOLBL3MBTL1
SCHEMBL19273150 1.00 HTR2C (0.31) HTR2CHTR2BDHFRPOLBL3MBTL1
SCHEMBL19252779 1.00 HTR2C (0.31) HTR2CHTR2BDHFRPOLBL3MBTL1
SCHEMBL19273152 1.00 HTR2C (0.31) HTR2CHTR2BDHFRPOLBL3MBTL1
SCHEMBL19273044 0.88 EHMT2 (0.33) POLB
SCHEMBL19273045 0.88 EHMT2 (0.33) POLB
SCHEMBL19270663 0.88 EHMT2 (0.33) POLB
SCHEMBL29613163 0.88 EHMT2 (0.33) POLB

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
CN-109071447-B Tetracyclic pyridinone compounds as antiviral agents 诺华股份有限公司 2022-04-22 CN disclosed