SCHEMBL3371585

SCHEMBL3371585

C=Cc1cccc(CCC(=C)C(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.41
PTGS2 P35354 1/20 0.40
ALDH1A1 P00352 4/20 0.39
TSHR P16473 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
PTPRB P23467 1/20 0.39
CDC25A P30304 1/20 0.39
CDC25B P30305 1/20 0.39
PTEN P60484 1/20 0.39
PTPMT1 Q8WUK0 1/20 0.39
KEAP1 Q14145 1/20 0.38
TP53 P04637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
FFAR1 O14842 3/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
MEN1 O00255 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
SCHEMBL20725124 0.85 KEAP1 (0.55) FAAHPTPRBCDC25ACDC25BPTEN
SCHEMBL7796878 0.84 FAAH (0.43) FAAHPTGS2ALDH1A1TSHRCYP3A4
Styrene SCHEMBL14801675 0.83 ALDH1A1 (0.50) ALDH1A1TSHRKEAP1TDP1FFAR1
SCHEMBL316895 0.82 FFAR1 (0.41) ALDH1A1TSHRKEAP1TDP1FFAR1
SCHEMBL17975817 0.80 FFAR1 (0.53) ALDH1A1PTPRBCDC25ACDC25BPTEN
SCHEMBL1137422 0.79 DRD2 (0.50) FFAR1
SCHEMBL2286187 0.78 PTPRC (0.38) ALDH1A1PTPRBCDC25ACDC25BPTEN
SCHEMBL1921167 0.78 CTBP2 (0.50) ALDH1A1CYP3A4CYP2C9TDP1MAPT
SCHEMBL1920986 0.78 FFAR1 (0.50) KEAP1FFAR1
SCHEMBL1919956 0.78 PLAAT3 (0.54) ALDH1A1FFAR1MEN1KMT2A

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9238715-B2 Polymerizable composition for ophthalmic and medical use and antimicrobial composition obtained by polymerizing the polymerizable composition NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2016-01-19 US claimed
EP-0944656-B1 PROCESS FOR PREPARING RUBBER-MODIFIED MOULDING COMPOUNDS BASF AG (DE) 2001-07-11 EP claimed
EP-0600269-B1 Soft ocular lens material MENICON CO LTD (JP) 1998-02-04 EP claimed
EP-3121643-B1 OPHTHALMIC LENS MENICON CO LTD (JP) 2020-07-22 EP disclosed
US-9622853-B2 Polymeric composition for ocular devices DAVE, Jagrat Natavar (IN) 2017-04-18 US disclosed
US-9310624-B2 Refractive-diffractive ophthalmic device and compositions useful for producing same Jagrat Natavar DAVE (IN) 2016-04-12 US disclosed
US-20160058552-A1 PHAKIC LENS DEVICE WITH OPENINGS AND CONCENTRIC ANNULAR ZONES DAVE, JAGRAT NATAVAR (IN) 2016-03-03 US disclosed
US-9238715-B2 Polymerizable composition for ophthalmic and medical use and antimicrobial composition obtained by polymerizing the polymerizable composition NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2016-01-19 US disclosed
US-20150359625-A1 TORIC-DIFFRACTIVE LENS DAVE, Jagrat Natavar (IN) 2015-12-17 US disclosed
US-9034942-B2 Polymer material, ophthalmic lens and contact lens MENICON CO., LTD. (JP) 2015-05-19 US disclosed
US-20140163133-A1 POLYMERIZABLE COMPOSITION FOR OPHTHALMIC AND MEDICAL USE AND ANTIMICROBIAL COMPOSITION OBTAINED BY POLYMERIZING THE POLYMERIZABLE COMPOSITION MENICON CO., LTD (JP) 2014-06-12 US disclosed
EP-1750157-A1 CONTACT LENS MENICON CO., LTD. (JP) 2007-02-07 EP disclosed
EP-1696257-A1 CONTACT LENS MATERIAL MENICON CO., LTD. (JP) 2006-08-30 EP disclosed
US-6852795-B2 Prepolymeric (meth)acrylates with polycyclic or aromatic segments 3M ESPE AG (DE) 2005-02-08 US disclosed
EP-1284979-B1 PREPOLYMERIC (METH)ACRYLATES WITH POLYCYCLIC OR AROMATIC SEGMENTS 3M ESPE AG (DE) 2004-12-29 EP disclosed
US-20030166816-A1 Prepolymeric (meth) acrylates with polycyclic or aromatic segments 3M INNOVATIVE PROPERTIES COMPANY 2003-09-04 US disclosed
EP-1284979-A1 PREPOLYMERIC (METH)ACRYLATES WITH POLYCYCLIC OR AROMATIC SEGMENTS 3M Espe AG (DE) 2003-02-26 EP disclosed
WO-2001092271-A1 PREPOLYMERIC (METH)ACRYLATES WITH POLYCYCLIC OR AROMATIC SEGMENTS 3M ESPE AG (DE) 2001-12-06 WO disclosed
EP-0944656-B1 PROCESS FOR PREPARING RUBBER-MODIFIED MOULDING COMPOUNDS BASF AG (DE) 2001-07-11 EP disclosed
US-5519070-A FLUORINE, ALKOXY POLYSILOXANE COPOLYMERS FOR INTRAOCULAR LENSES MENICON CO., LTD. (JP) 1996-05-21 US disclosed