SCHEMBL12809240

SCHEMBL12809240

CNCc1cc(Oc2ccc(O)c(CNC)c2)ccc1O

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 19/20 0.47
▸ SLC6A4 P31645 19/20 0.47
▸ KCNH2 Q12809 17/20 0.47
▸ LMNA P02545 1/20 0.44
▸ GAA P10253 1/20 0.44

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
SCHEMBL12809230 0.92 HTR2A (0.42) HTR2ASLC6A4KCNH2LMNAGAA
SCHEMBL13030044 0.80 AMY1A (0.60) LMNAGAA
SCHEMBL11674343 0.78 EGFR (0.60) —
SCHEMBL921473 0.78 ESR1 (0.52) —
SCHEMBL10069990 0.76 CA1 (0.52) SLC6A4LMNAGAA
SCHEMBL27759343 0.76 MAPT (0.46) SLC6A4LMNA
SCHEMBL3188794 0.75 KLF10 (0.48) —
SCHEMBL12809048 0.75 MAOB (0.56) LMNAGAA
SCHEMBL12305651 0.74 MEN1 (0.67) HTR2ASLC6A4KCNH2LMNA
SCHEMBL21417797 0.74 PRKCI (0.56) LMNAGAA

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-1476493-B1 CURABLE COMPOSITIONS CONTAINING BENZOXAZINE HENKEL AG & CO KGAA (DE) 2011-03-09 — — EP disclosed
WO-2009067112-A1 REDOX-INDUCED CATIONICALLY POLYMERIZABLE COMPOSITIONS WITH LOW CURE TEMPERATURE HENKEL AG & CO. KGAA (DE) 2009-05-28 — — WO disclosed
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