SCHEMBL16384878

SCHEMBL16384878

OC(c1ccccc1)(c1ccccc1)c1ccc2ccccc2c1-c1ccc2ccccc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ CYP1A2 P05177 2/20 0.54
▸ CYP2D6 P10635 2/20 0.54
▸ CYP2C9 P11712 2/20 0.54
▸ CYP2C19 P33261 2/20 0.54
▸ HIF1A Q16665 2/20 0.54
▸ CFTR P13569 1/20 0.42
▸ GOPC Q9HD26 1/20 0.42
▸ GPR84 Q9NQS5 1/20 0.42
▸ ESR1 P03372 1/20 0.39
▸ ESR2 Q92731 1/20 0.39
▸ ALOX5 P09917 3/20 0.38
▸ AKR1C3 P42330 2/20 0.38
▸ AKR1C2 P52895 2/20 0.38
▸ WDR5 P61964 1/20 0.37
▸ HSD17B1 P14061 1/20 0.37
▸ HSD17B2 P37059 1/20 0.37
▸ PTGER3 P43115 1/20 0.36
▸ HDAC4 P56524 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
SCHEMBL15505858 0.87 HSD17B10 (0.60) HPGDHSD17B10CYP1A2CYP2D6CYP2C9
SCHEMBL23743323 0.79 FABP3 (0.48) HPGDHSD17B10CYP1A2CYP2D6CYP2C9
SCHEMBL16384836 0.78 HPGD (0.57) HPGDHSD17B10CYP1A2CYP2D6CYP2C9
SCHEMBL13152865 0.77 ALOX5 (0.42) HPGDHSD17B10CYP1A2CYP2D6CYP2C9
SCHEMBL2328498 0.77 HSD17B10 (0.59) HPGDHSD17B10CYP1A2CYP2D6CYP2C9
SCHEMBL14901084 0.72 CYP1A2 (0.41) HPGDHSD17B10CYP1A2CYP2D6CYP2C9
SCHEMBL22795574 0.72 ALOX5 (0.60) HSD17B10CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL3627027 0.71 CYP1A2 (0.52) HPGDHSD17B10CYP1A2CYP2D6CYP2C9
SCHEMBL2355481 0.71 CYP1A2 (0.59) HPGDHSD17B10CYP1A2CYP2D6CYP2C9
SCHEMBL18017190 0.71 CYP1A2 (0.47) HPGDHSD17B10CYP1A2CYP2D6CYP2C9

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-2015005440-A1 MATERIAL FOR LIGHT-EMITTING AUXILIARY LAYER COMPRISING RING-FUSED FLUORENE COMPOUND OR FLUORENE COMPOUND JNC株式会社 (JP) 2015-01-15 — — WO disclosed
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