SCHEMBL35503

SCHEMBL35503

C=CC(=O)OCCC[N+](C)(C)CCCS(=O)(=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.47
BBOX1 O75936 3/20 0.47
HPGD P15428 1/20 0.47
ALDH1A1 P00352 3/20 0.47
CYP3A4 P08684 1/20 0.47
TP53 P04637 2/20 0.40
HIF1A Q16665 2/20 0.40
HSD17B10 Q99714 1/20 0.40
THRB P10828 2/20 0.35
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
GRK2 P25098 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL16799372 0.96 TSHR (0.50) TSHRBBOX1HPGDALDH1A1CYP3A4
SCHEMBL16798967 0.94 TSHR (0.49) TSHRBBOX1HPGDALDH1A1CYP3A4
SCHEMBL16798995 0.94 TSHR (0.53) TSHRBBOX1HPGDALDH1A1CYP3A4
SCHEMBL18151515 0.94 TSHR (0.49) TSHRBBOX1HPGDALDH1A1CYP3A4
SCHEMBL16798999 0.94 TSHR (0.53) TSHRBBOX1HPGDALDH1A1CYP3A4
SCHEMBL16799249 0.94 TSHR (0.49) TSHRBBOX1HPGDALDH1A1CYP3A4
SCHEMBL16799079 0.94 TSHR (0.53) TSHRBBOX1HPGDALDH1A1CYP3A4
SCHEMBL16799087 0.94 TSHR (0.53) TSHRBBOX1HPGDALDH1A1CYP3A4
SCHEMBL18151644 0.94 TSHR (0.53) TSHRBBOX1HPGDALDH1A1CYP3A4
SCHEMBL16799361 0.94 TSHR (0.49) TSHRBBOX1HPGDALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3481897-B9 SILICONE HYDROGELS COMPRISING POLYAMIDES JOHNSON & JOHNSON VISION CARE (US) 2024-04-10 EP claimed
EP-3481897-B1 SILICONE HYDROGELS COMPRISING POLYAMIDES JOHNSON & JOHNSON VISION CARE (US) 2024-01-03 EP claimed
US-11828913-B2 Silicone hydrogels comprising polyamides JOHNSON & JOHNSON VISION CARE, INC. (US) 2023-11-28 US claimed
CN-109790353-B Silicone hydrogels comprising polyamides 庄臣及庄臣视力保护公司 2021-12-03 CN claimed
US-20210141122-A1 SILICONE HYDROGELS COMPRISING POLYAMIDES JOHNSON & JOHNSON VISION CARE (US) 2021-05-13 US claimed
US-10890689-B2 Silicone hydrogels comprising polyamides JOHNSON & JOHNSON VISION CARE, INC. (US) 2021-01-12 US claimed
US-20190317248-A1 SILICONE HYDROGELS COMPRISING POLYAMIDES JOHNSON & JOHNSON VISION CARE (US) 2019-10-17 US claimed
US-10371865-B2 Silicone hydrogels comprising polyamides JOHNSON & JOHNSON VISION CARE, INC. (US) 2019-08-06 US claimed
EP-3401342-A1 POLYMERS AND NANOGEL MATERIALS AND METHODS FOR MAKING AND USING THE SAME Johnson & Johnson Vision Care, Inc. (US) 2018-11-14 EP claimed
US-10073192-B2 Polymers and nanogel materials and methods for making and using the same JOHNSON & JOHNSON VISION CARE, INC. (US) 2018-09-11 US claimed
US-20180011222-A1 SILICONE HYDROGELS COMPRISING POLYAMIDES JOHNSON & JOHNSON VISION CARE, INC. 2018-01-11 US claimed
US-9617423-B2 Macroinitiator containing hydrophobic segment JOHNSON & JOHNSON VISION CARE, INC. (US) 2017-04-11 US claimed
US-20160194497-A1 MACROINITIATOR CONTAINING HYDROPHOBIC SEGMENT JOHNSON & JOHNSON VISION CARE (US) 2016-07-07 US claimed
EP-2855544-A2 POLYMERS AND NANOGEL MATERIALS AND METHODS FOR MAKING AND USING THE SAME Johnson & Johnson Vision Care Inc. (US) 2015-04-08 EP claimed
WO-2013176886-A2 POLYMERS AND NANOGEL MATERIALS AND METHODS FOR MAKING AND USING THE SAME JOHNSON & JOHNSON VISION CARE, INC. (US) 2013-11-28 WO claimed
US-20130317131-A1 POLYMERS AND NANOGEL MATERIALS AND METHODS FOR MAKING AND USING THE SAME JOHNSON & JOHNSON VISION CARE, INC. (US) 2013-11-28 US claimed
US-12638613-B2 Ophthalmic lenses and their manufacture by in-mold modification JOHNSON & JOHNSON VISION CARE, INC. (US) 2026-05-26 US disclosed
US-12624214-B2 Polymerizable absorbers of UV and high energy visible light JOHNSON & JOHNSON VISION CARE, INC. (US) 2026-05-12 US disclosed
WO-2011140318-A1 NON-REACTIVE, HYDROPHILIC POLYMERS HAVING TERMINAL SILOXANES AND USES OF THE SAME JOHNSON & JOHNSON VISION CARE, INC. (US) 2011-11-10 WO disclosed
US-20110275734-A1 NON-REACTIVE, HYDROPHILIC POLYMERS HAVING TERMINAL SILOXANES AND METHODS FOR MAKING AND USING THE SAME JOHNSON & JOHNSON VISION CARE, INC. 2011-11-10 US 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-12638613-B2 Ophthalmic lenses and their manufacture by in-mold modification UACA, AXL, CRYZ TSHR 2482/4885BBOX1 1460/4885HPGD 4544/4885
US-12624214-B2 Polymerizable absorbers of UV and high energy visible light CRY1, SCNN1G, MALT1 TSHR 832/4885BBOX1 3923/4885HPGD 527/4885

“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.