SCHEMBL10604208

SCHEMBL10604208

CCCCOc1ccc2cc(OCc3ccccc3)ccc2c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.71
▸ CYP3A4 P08684 1/20 0.54
▸ CHRNB2 P17787 1/20 0.54
▸ CHRNB4 P30926 1/20 0.54
▸ CHRNA3 P32297 1/20 0.54
▸ CHRNA7 P36544 1/20 0.54
▸ CHRNA4 P43681 1/20 0.54
▸ NPC1 O15118 3/20 0.54
▸ MEN1 O00255 2/20 0.54
▸ RAB9A P51151 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ GPBAR1 Q8TDU6 2/20 0.54
▸ CYSLTR2 Q9NS75 1/20 0.54
▸ CYSLTR1 Q9Y271 1/20 0.54
▸ LTA4H P09960 1/20 0.53
▸ MAOB P27338 2/20 0.53
▸ CA12 O43570 1/20 0.51
▸ CA1 P00915 1/20 0.51
▸ CA2 P00918 1/20 0.51
▸ CA3 P07451 1/20 0.51

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
SCHEMBL5238958 0.89 LTA4H (0.66) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL30539400 0.86 LTA4H (0.68) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL27974031 0.84 LTA4H (0.66) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL15923575 0.84 LTA4H (0.66) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL7050035 0.84 LTA4H (0.69) CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4
SCHEMBL470925 0.83 TDP1 (0.68) ALOX5NPC1RAB9AGPBAR1CYSLTR2
SCHEMBL8984340 0.83 ALOX5 (0.92) ALOX5CYP3A4NPC1MEN1RAB9A
SCHEMBL51460 0.83 ALOX5 (1.00) ALOX5CYP3A4NPC1MEN1RAB9A
SCHEMBL29666114 0.83 TDP1 (0.68) ALOX5NPC1RAB9AGPBAR1CYSLTR2
SCHEMBL29773855 0.83 MAOB (0.63) GPBAR1CYSLTR2CYSLTR1LTA4HMAOB

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-0189760-B1 THERMOSENSITIVE RECORDING SHEET JUJO PAPER CO., LTD. (JP) 1989-07-19 — — EP disclosed
US-4721701-A Thermosensitive recording sheet JUJO PAPER CO., LTD. (JP) 1988-01-26 — — US disclosed
EP-0189760-A1 Thermosensitive recording sheet JUJO PAPER CO., LTD. (JP) 1986-08-06 — — EP disclosed
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