SCHEMBL27306242

SCHEMBL27306242

CCC1=CC(C)(CC)Nc2c(OC)cc(Nc3ccccc3)cc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STK10 O94804 4/20 0.36
▸ SLK Q9H2G2 4/20 0.36
▸ GSK3B P49841 1/20 0.34
▸ BRAF P15056 1/20 0.34
▸ NR3C1 P04150 5/20 0.33
▸ PDGFRB P09619 2/20 0.33
▸ PDGFRA P16234 1/20 0.33
▸ EGFR P00533 1/20 0.32
▸ SRC P12931 1/20 0.32
▸ PGR P06401 3/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ POLB P06746 1/20 0.30
▸ RAD52 P43351 1/20 0.30
▸ APP P05067 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ ALOX12 P18054 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ HTT P42858 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
SCHEMBL27306239 0.85 APP (0.35) EGFRSRCMEN1KMT2AAPP
SCHEMBL27306358 0.85 APP (0.32) APPMAPTHPGDMAPK1
SCHEMBL27306816 0.84 ALDH1A1 (0.38) NR3C1EGFRMEN1KMT2AMAPT
SCHEMBL27306369 0.84 APP (0.32) STK10SLKGSK3BAPP
SCHEMBL27306478 0.82 APP (0.30) APP
SCHEMBL27306484 0.81 NR3C1 (0.31) NR3C1
SCHEMBL27306611 0.80 NR3C1 (0.32) NR3C1
SCHEMBL27305823 0.78 ALDH1A1 (0.41) STK10SLKGSK3BBRAFNR3C1
SCHEMBL27306729 0.77 MEN1 (0.32) NR3C1MEN1KMT2A
SCHEMBL27306821 0.76 STK10 (0.36) STK10SLKGSK3BBRAFPDGFRB

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-2023235855-A1 QUINOLINEAMINE ANTIDEGRADANT COMPOUNDS AND USES THEREOF FLEXSYS AMERICA L.P. (US) 2023-12-07 — — WO disclosed
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