SCHEMBL6994031

SCHEMBL6994031

Cc1c2c(c3ccccc3c1C)OC(c1ccccc1)(c1ccccc1)C=C2

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.35
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
XBP1 P17861 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL1845200 0.86 MEN1 (0.35) HSD17B10NPC1POLBMAPTRAB9A
SCHEMBL7971543 0.84 KIF11 (0.40) HSD17B10NPC1MAPTRAB9A
SCHEMBL12205494 0.82 ACHE (0.38) HSD17B10NPC1POLBMAPTRAB9A
SCHEMBL9185542 0.81 HSD17B10 (0.33) HSD17B10NPC1POLBMAPTXBP1
SCHEMBL7608091 0.80 SMN1; SMN2 (0.41) NPC1MAPTRAB9A
SCHEMBL12610465 0.79 SMN1; SMN2 (0.34) NPC1POLBRAB9A
SCHEMBL14293568 0.78 EDNRA (0.36) NPC1RAB9A
SCHEMBL1844892 0.78 AHR (0.39) NPC1RAB9A
SCHEMBL7592911 0.76 PARP1 (0.33) HSD17B10
SCHEMBL22145138 0.74 KDM4E (0.38) HSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0926146-B1 CHROMENE COMPOUNDS TOKUYAMA CORP (JP) 2003-02-12 EP disclosed
US-6197225-B1 PHOTOCHROMIC LENS MADE OF A POLYMER OF A PHOTOCHROMIC POLYMERIZABLE COMPOSITION TOKUYAMA CORPORATION (JP) 2001-03-06 US disclosed
EP-0926146-A1 CHROMENE COMPOUNDS TOKUYAMA CORPORATION (JP) 1999-06-30 EP disclosed