SCHEMBL4413671

SCHEMBL4413671

O=[PH](OCCCCc1ccc(Br)cc1)OCCCCc1ccc(Br)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.45
HTR2A P28223 1/20 0.45
HMOX1 P09601 1/20 0.38
HSP90AA1 P07900 1/20 0.36
IDO1 P14902 3/20 0.35
LTB4R Q15722 1/20 0.35
LTB4R2 Q9NPC1 1/20 0.35
FFAR1 O14842 2/20 0.35
FFAR4 Q5NUL3 1/20 0.35
MAOB P27338 2/20 0.35
PLAAT3 P53816 1/20 0.35
PLAAT5 Q96KN8 1/20 0.35
PLAAT2 Q9NWW9 1/20 0.35
PLAAT4 Q9UL19 1/20 0.35
MAOA P21397 1/20 0.35

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
SCHEMBL4415096 0.94 TAAR1 (0.47) TAAR1HTR2AHMOX1IDO1FFAR1
SCHEMBL4408254 0.86 TAAR1 (0.50) TAAR1HTR2AIDO1FFAR1FFAR4
SCHEMBL28991973 0.86 TAAR1 (0.42) TAAR1HTR2AHMOX1HSP90AA1IDO1
SCHEMBL4407153 0.81 IDO1 (0.34) IDO1
SCHEMBL10773558 0.81 TAAR1 (0.45) TAAR1MAOB
SCHEMBL4414070 0.81 MAOB (0.50) HTR2AIDO1FFAR1MAOBMAOA
SCHEMBL4417343 0.81 IGF1R (0.32)
SCHEMBL4920782 0.79 MAPT (0.48) IDO1FFAR1MAOBMAOA
SCHEMBL14890565 0.79 MAPT (0.48) IDO1FFAR1MAOBMAOA
SCHEMBL31403380 0.78 TAAR1 (0.48) TAAR1HTR2AHMOX1HSP90AA1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116041392-A Compound containing phosphate group, preparation method and application thereof 中国科学院长春应用化学研究所 2023-05-02 CN disclosed
US-7635748-B2 Resin and article molded therefrom TORAY INDUSTRIES, INC. (JP) 2009-12-22 US disclosed
EP-1270646-B1 RESIN COMPOSITION AND ARTICLES MOLDED THEREFROM TORAY INDUSTRIES (JP) 2008-11-26 EP disclosed
US-20080139778-A1 Resin and article molded therefrom TAKANISHI KEIJIRO 2008-06-12 US disclosed
US-20060287464-A1 Resin and article molded therefrom TORAY INDUSTRIES, INC. (JP) 2006-12-21 US disclosed
EP-1640405-A1 RESIN AND ARTICLE MOLDED THEREFROM TORAY INDUSTRIES, INC. (JP) 2006-03-29 EP disclosed
US-6750313-B2 HIGH REFRACTIVE INDEX AND LOW DISPERSION CHARACTERISTICS; OPTICAL LENSES, FILMS, DISCS; POLYCARBONATE RESIN CONTAINING A PHOSPHONIC ACID GROUP TORAY INDUSTRIES, INC. (JP) 2004-06-15 US disclosed
US-20030013836-A1 Resin composition and articles molded therefrom TORAY INDUSTRIES, INC., A CORPORATION OF JAPAN (JP) 2003-01-16 US disclosed
EP-1270646-A1 RESIN COMPOSITION AND ARTICLES MOLDED THEREFROM TORAY INDUSTRIES, INC. (JP) 2003-01-02 EP disclosed