SCHEMBL2452377

SCHEMBL2452377

C=CC(=O)NCc1ccc(CO)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.71
▸ EPHX2 P34913 1/20 0.46
▸ ALDH1A1 P00352 4/20 0.45
▸ TSHR P16473 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ LMNA P02545 2/20 0.45
▸ CYP2D6 P10635 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ MMP1 P03956 1/20 0.42
▸ MMP2 P08253 1/20 0.42
▸ MMP9 P14780 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC2 Q92769 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ TPSAB1 Q15661 2/20 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
SCHEMBL732934 0.92 TGM2 (0.81) TGM2ALDH1A1TSHRMAPK1TDP1
SCHEMBL8604613 0.85 TGM2 (0.67) TGM2ALDH1A1TSHRMAPK1TDP1
SCHEMBL124217 0.85 TGM2 (0.71) TGM2ALDH1A1TSHRMAPK1TDP1
SCHEMBL8966436 0.83 TGM2 (1.00) TGM2ALDH1A1TSHRMAPK1TDP1
SCHEMBL2723387 0.83 TGM2 (0.69) TGM2ALDH1A1TSHRMAPK1TDP1
SCHEMBL2722983 0.83 TGM2 (0.74) TGM2ALDH1A1TSHRMAPK1TDP1
SCHEMBL5071229 0.83 TGM2 (0.69) TGM2ALDH1A1LMNACYP2C19MEN1
SCHEMBL4927519 0.83 TGM2 (0.69) TGM2ALDH1A1TDP1LMNACYP2C19
SCHEMBL3298245 0.83 TGM2 (0.69) TGM2EPHX2ALDH1A1TSHRMAPK1
SCHEMBL9179038 0.83 TGM2 (0.69) TGM2ALDH1A1TSHRMAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2547688-B1 SILICONE (METH)ACRYLAMIDE MONOMER, POLYMER, OPHTHALMIC LENS, AND CONTACT LENS JOHNSON & JOHNSON VISION CARE (US) 2014-12-17 — — EP disclosed
US-8623934-B2 Silicone (meth)acrylamide monomer, polymer, ophthalmic lens, and contact lens JOHNSON & JOHNSON VISION CARE, INC. (US) 2014-01-07 — — US disclosed
US-8541483-B2 Silicone (meth)acrylamide monomer, polymer, ophthalmic lens, and contact lens JOHNSON & JOHNSON VISION CARE, INC. (US) 2013-09-24 — — US disclosed
US-20130197176-A1 SILICONE (METH)ACRYLAMIDE MONOMER, POLYMER, OPHTHALMIC LENS, AND CONTACT LENS JOHNSON & JOHNSON VISION CARE, INC. (US) 2013-08-01 — — US disclosed
US-20130178594-A1 SILICONE (METH)ACRYLAMIDE MONOMER, POLYMER, OPHTHALMIC LENS, AND CONTACT LENS JOHNSON & JOHNSON VISION CARE, INC. (US) 2013-07-11 — — US disclosed
US-8415405-B2 Silicone (meth)acrylamide monomer, polymer, ophthalmic lens, and contact lens JOHNSON & JOHNSON VISION CARE, INC. (US) 2013-04-09 — — US disclosed
EP-2547688-A1 SILICONE (METH)ACRYLAMIDE MONOMER, POLYMER, OPHTHALMIC LENS, AND CONTACT LENS Johnson & Johnson Vision Care, Inc. (US) 2013-01-23 — — EP disclosed
US-20110237766-A1 SILICONE (METH)ACRYLAMIDE MONOMER, POLYMER, OPHTHALMIC LENS, AND CONTACT LENS JOHNSON & JOHNSON VISION CARE, INC. 2011-09-29 — — US disclosed
WO-2011116206-A1 SILICONE (METH)ACRYLAMIDE MONOMER, POLYMER, OPHTHALMIC LENS, AND CONTACT LENS JOHNSON & JOHNSON VISION CARE, INC. (US) 2011-09-22 — — WO disclosed
US-20080177002-A1 Thermoplastic Resin Composition, Optical Film, And Process For Producing Film JSR CORPORATION (JP) 2008-07-24 — — US disclosed
EP-1837374-A1 THERMOPLASTIC RESIN COMPOSITION, OPTICAL FILM, AND PROCESS FOR PRODUCING FILM JSR Corporation (JP) 2007-09-26 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130197176-A1 SILICONE (METH)ACRYLAMIDE MONOMER, POLYMER, OPHTHALMIC LENS, AND CONTACT LENS CRYAA, MGMT, UACA TGM2 1299/4885EPHX2 4110/4885ALDH1A1 3017/4885
US-20110237766-A1 SILICONE (METH)ACRYLAMIDE MONOMER, POLYMER, OPHTHALMIC LENS, AND CONTACT LENS CRYAA, MGMT, UACA TGM2 1299/4885EPHX2 4110/4885ALDH1A1 3017/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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