SCHEMBL14223465

SCHEMBL14223465

COc1cc(C2OCC2(C)C)ccc1OC(C)OC

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 5/20 0.40
▸ EPAS1 Q99814 4/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ SOAT2 O75908 1/20 0.38
▸ SOAT1 P35610 1/20 0.38
▸ ACHE P22303 1/20 0.37
▸ MAPK3 P27361 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ PTAFR P25105 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ NR3C1 P04150 1/20 0.36

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
SCHEMBL14223506 0.86 HDAC1 (0.39) HIF1AEPAS1ALDH1A1SOAT2SOAT1
SCHEMBL14590522 0.84 ALDH1A1 (0.43) ALDH1A1ACHEMAPK3MAPK1PTAFR
SCHEMBL14223505 0.84 HTR2A (0.37) HIF1AEPAS1ALDH1A1SOAT2SOAT1
SCHEMBL14590570 0.81 FDPS (0.44) HIF1AEPAS1ALDH1A1ACHEMAPK3
SCHEMBL14590511 0.79 ALDH1A1 (0.37) ALDH1A1ACHEMAPK3MAPK1PTAFR
SCHEMBL13651782 0.79 ALDH1A1 (0.37) ALDH1A1ACHEMAPK3MAPK1PTAFR
SCHEMBL14223490 0.79 NPC1 (0.33) —
SCHEMBL14590599 0.78 PDE4A (0.41) HIF1AEPAS1ALDH1A1ACHEMAPK3
SCHEMBL14193805 0.77 FDPS (0.41) HIF1AEPAS1ALDH1A1ACHEMAPK3
SCHEMBL14590594 0.75 ACHE (0.36) ALDH1A1ACHEMAPK3MAPK1PTAFR

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
US-7360883-B2 Active ray curable ink, image forming method and ink-jet recording apparatus KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-04-22 — — US disclosed
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