SCHEMBL30746565

SCHEMBL30746565

Cc1c(Oc2ccc(Cl)cn2)cncc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 8/20 0.39
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
DGAT1 O75907 1/20 0.34
EGFR P00533 2/20 0.31
KEAP1 Q14145 1/20 0.31
GRM8 O00222 1/20 0.31
GRM7 Q14831 1/20 0.31
GRM4 Q14833 1/20 0.31
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
SCHEMBL26985696 1.00 LIPE (0.39) LIPEPTGS1PTGS2DGAT1EGFR
SCHEMBL26985737 0.84 PTGS1 (0.40) LIPEPTGS1PTGS2
SCHEMBL30746484 0.84 PTGS1 (0.40) LIPEPTGS1PTGS2
SCHEMBL26985480 0.79 EGFR (0.35) LIPEEGFR
SCHEMBL26985444 0.79 SLC6A2 (0.37) LIPEPTGS1PTGS2EGFR
SCHEMBL30746522 0.79 EGFR (0.35) LIPEEGFR
SCHEMBL30746489 0.78 HTT (0.38) DGAT1EGFRL3MBTL1
SCHEMBL26985465 0.78 HTT (0.38) DGAT1EGFRL3MBTL1
SCHEMBL30746551 0.76 SLC22A12 (0.34) PTGS1PTGS2EGFRL3MBTL1
SCHEMBL30746549 0.76 SLC22A12 (0.34) PTGS1PTGS2EGFRL3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4551558-A2 MITOGEN-ACTIVATED PROTEIN KINASE (MEK) INHIBITORS Nested Therapeutics, Inc. (US) 2025-05-14 EP disclosed
WO-2024010925-A2 MITOGEN-ACTIVATED PROTEIN KINASE (MEK) INHIBITORS NESTED THERAPEUTICS, INC. (US) 2024-01-11 WO disclosed