SCHEMBL722685

SCHEMBL722685

CCc1c(CC(C)C)ccc(C(=O)O)c1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.38
ALDH1A1 P00352 5/20 0.38
MEN1 O00255 4/20 0.38
HPGD P15428 4/20 0.38
KMT2A Q03164 4/20 0.38
AKR1C2 P52895 2/20 0.37
AKR1C1 Q04828 1/20 0.37
PTGS1 P23219 3/20 0.37
PTGS2 P35354 3/20 0.37
CYP2C9 P11712 2/20 0.37
AKR1C3 P42330 2/20 0.37
CXCR1 P25024 2/20 0.37
CXCR2 P25025 2/20 0.37
ALB P02768 1/20 0.37
ESR1 P03372 1/20 0.37
ALOX5 P09917 1/20 0.37
RARB P10826 1/20 0.37
ADRB3 P13945 1/20 0.37
NFKB1 P19838 1/20 0.37
HTR2A P28223 1/20 0.37

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
SCHEMBL77326 0.90 LMNA (0.39) LMNAALDH1A1MEN1HPGDKMT2A
SCHEMBL27494885 0.89 LMNA (0.39) LMNAALDH1A1MEN1HPGDKMT2A
SCHEMBL722686 0.89 LMNA (0.38) LMNAALDH1A1MEN1HPGDKMT2A
SCHEMBL4627581 0.87 ALDH1A1 (0.46) LMNAALDH1A1MEN1HPGDKMT2A
SCHEMBL75798 0.86 ALDH1A1 (0.41) ALDH1A1MEN1HPGDKMT2ATSHR
SCHEMBL17911667 0.84 GABRP (0.40) ALDH1A1MEN1HPGDKMT2ATSHR
Phthalic Acid SCHEMBL29113646 0.84 ALDH1A1 (0.44) LMNAALDH1A1MEN1HPGDKMT2A
Phthalic Acid SCHEMBL31462355 0.84 ALDH1A1 (0.44) LMNAALDH1A1MEN1HPGDKMT2A
Phthalic Acid SCHEMBL31465164 0.83 ALDH1A1 (0.41) LMNAALDH1A1MEN1HPGDKMT2A
Acetic Acid SCHEMBL10946506 0.83 GABRP (0.39) ALDH1A1MEN1HPGDKMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6878659-B2 Solid catalyst component for olefin polymerization and catalyst TOHO TITANIUM CO., LTD. (JP) 2005-04-12 US claimed
US-8648001-B2 Aminosilane compounds, catalyst components and catalysts for olefin polymerization, and process for production of olefin polymers with the same TOHO TITANIUM CO., LTD. (JP) 2014-02-11 US disclosed
US-20120053310-A1 Aminosilane Compounds, Catalyst Components and Catalysts for Olefin Polymerization, and Process for Production of Olefin Polymers with the Same TOHO TITANIUM CO., LTD. (JP) 2012-03-01 US disclosed
US-7208435-B2 Solid catalyst component for olefin polymerization and catalyst TOHO CATALYST CO., LTD. (JP) 2007-04-24 US disclosed
US-7141634-B2 Catalyst for olefin polymerization and process for polymerizing olefins TOHO CATALYST CO., LTD. (JP) 2006-11-28 US disclosed
US-6878659-B2 Solid catalyst component for olefin polymerization and catalyst TOHO TITANIUM CO., LTD. (JP) 2005-04-12 US disclosed
US-20050054773-A1 Solid catalyst component for olefin polymerization, catalyst, and propylene block copolymer TOHO CATALYST CO, LTD. (JP) 2005-03-10 US disclosed