SCHEMBL18040865

SCHEMBL18040865

[O-]/[N+](O)=C\c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ G6PD P11413 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.46
▸ FBP1 P09467 4/20 0.43
▸ ALDH1A1 P00352 7/20 0.42
▸ MAPT P10636 4/20 0.42
▸ TSHR P16473 2/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ PRMT1 Q99873 1/20 0.42
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ KMT2A Q03164 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ CYP2A6 P11509 1/20 0.38

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
SCHEMBL9341341 0.75 NPC1 (0.50) G6PDTDP1FBP1ALDH1A1MAPT
SCHEMBL9341340 0.75 NPC1 (0.50) G6PDTDP1FBP1ALDH1A1MAPT
SCHEMBL22575907 0.74 G6PD (0.47) G6PDPOLBGAATDP1FBP1
SCHEMBL1404289 0.74 G6PD (0.47) G6PDPOLBGAATDP1FBP1
SCHEMBL17689681 0.74 TDP1 (0.41) G6PDPOLBGAATDP1FBP1
SCHEMBL6045147 0.74 G6PD (0.47) G6PDPOLBGAATDP1FBP1
SCHEMBL10448311 0.74 G6PD (0.47) G6PDPOLBGAATDP1FBP1
SCHEMBL14617615 0.72 G6PD (0.45) G6PDPOLBGAATDP1FBP1
SCHEMBL19217996 0.72 ALDH1A1 (0.41) G6PDPOLBGAATDP1ALDH1A1
SCHEMBL264278 0.72 ALDH1A1 (0.73) G6PDPOLBGAATDP1FBP1

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
EP-1607446-B1 ORGANIC/INORGANIC HYBRID MATERIAL, COMPOSITION FOR SYNTHESIZING THE SAME AND PROCESS FOR PRODUCING THE HYBRID MATERIAL SEMICONDUCTOR ENERGY LAB (JP) 2016-09-07 — — EP claimed
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