SCHEMBL5529861

SCHEMBL5529861

COC(=O)CCc1ccc([PH](=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 2/20 0.46
▸ CYP4A11 Q02928 2/20 0.46
▸ F2RL1 P55085 1/20 0.45
▸ ADRB2 P07550 1/20 0.45
▸ ADRB1 P08588 1/20 0.45
▸ IDO1 P14902 1/20 0.44
▸ EPHX2 P34913 1/20 0.43
▸ HRH3 Q9Y5N1 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ CA12 O43570 1/20 0.41
▸ CA7 P43166 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ CA14 Q9ULX7 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ TSHR P16473 1/20 0.40

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
SCHEMBL22922181 0.85 CYP4F2 (0.59) CYP4F2CYP4A11F2RL1ADRB2ADRB1
SCHEMBL15327762 0.85 EPHX2 (0.45) CYP4F2CYP4A11F2RL1ADRB2ADRB1
SCHEMBL5530289 0.79 TDP1 (0.53) CYP4F2CYP4A11ALDH1A1LMNAMAPT
SCHEMBL693698 0.79 CYP4F2 (0.49) CYP4F2CYP4A11F2RL1ADRB2ADRB1
4-Hydroxyhydrocinnamic Acid Methyl Ester SCHEMBL95254 0.78 HDAC2 (0.53) CYP4F2CYP4A11F2RL1ADRB2ADRB1
SCHEMBL65140 0.78 FFAR1 (0.59) LMNA
SCHEMBL2569441 0.78 L3MBTL1 (0.55) CYP4F2CYP4A11F2RL1ADRB2ADRB1
SCHEMBL1410420 0.78 CYP4A11 (0.56) CYP4F2CYP4A11F2RL1ADRB2ADRB1
SCHEMBL8508610 0.78 CYP4F2 (0.53) CYP4F2CYP4A11F2RL1ADRB2ADRB1
SCHEMBL3679325 0.78 CYP4A11 (0.72) CYP4F2CYP4A11F2RL1ADRB2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070194479-A1 Thermoplastic Resin Composition For Masterbatches, Method Of Producing Molding Material Thereof, And Thermoplastic Resin Composition Using Them And Method Of Production Thereof TOYO BOSEKI KABUSHIKI KAISHA (JP) 2007-08-23 — — US disclosed
EP-1693403-A1 THERMOPLASTIC RESIN COMPOSITION FOR MASTERBATCH, PROCESS FOR PRODUCING MOLDING MATERIAL COMPRISING THE SAME, THERMOPLASTIC RESIN COMPOSITION OBTAINED WITH THE SAME, AND PROCESS FOR PRODUCING THE COMPOSITION Toyo Boseki Kabushiki Kaisha (JP) 2006-08-23 — — EP disclosed
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