SCHEMBL2679520

SCHEMBL2679520

C=C(C)COCC(O)CN(CC(=O)O)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR174 Q9BXC1 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
ABCB1 P08183 4/20 0.34
PLA2G2A P14555 1/20 0.34
BLM P54132 1/20 0.34
EGFR P00533 2/20 0.33
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 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
SCHEMBL65014 0.83 TSHR (0.40) TDP1ABCB1PLA2G2ABLM
SCHEMBL11030769 0.77 ALDH1A1 (0.31) ABCB1
SCHEMBL14409178 0.76 THRB (0.40) TDP1ABCB1
SCHEMBL4102932 0.74 LMNA (0.35) TDP1ABCB1PLA2G2ABLM
SCHEMBL10870300 0.74 GPR84 (0.49) PLA2G2ABLM
SCHEMBL17075258 0.74 ALDH1A1 (0.41) TDP1
SCHEMBL2036583 0.73 TSHR (0.38) TDP1ABCB1PLA2G2ABLM
SCHEMBL16858009 0.73 TDP1 (0.42) TDP1
SCHEMBL25398188 0.73 ALDH1A1 (0.35) TDP1EGFR
SCHEMBL18177923 0.72 TSHR (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117917236-A Storage-stable self-adhesive composite cements with good transparency and good radiopacity 义获嘉伟瓦登特公司 2024-04-23 CN claimed
CN-116350518-A Self-adhesive dental composite cement with good transparency 义获嘉伟瓦登特公司 2023-06-30 CN claimed
CN-116350520-A Self-adhesive dental composite cement with good transparency based on acid treated fillers 义获嘉伟瓦登特公司 2023-06-30 CN claimed
CN-116350519-A Sulfate-or phosphate-containing self-adhesive dental composite cements with good transparency 义获嘉伟瓦登特公司 2023-06-30 CN claimed
US-4373035-A Isotonic monomer formulations AMERICAN DENTAL ASSOCIATION HEALTH FOUNDATION (US) 1983-02-08 US claimed
JP-2238002-A None JP disclosed
CN-113292594-B Long wave absorption photoinitiator 义获嘉伟瓦登特公司 2023-09-05 CN disclosed
US-8697772-B2 Polymerizable phosphoric acid derivatives comprising a polyalicylic structure element VOCO GMBH (DE) 2014-04-15 US disclosed
US-20120115108-A1 POLYMERIZABLE PHOSPHORIC ACID DERIVATIVES COMPRISING A POLYALICYLIC STRUCTURE ELEMENT VOCO GMBH (DE) 2012-05-10 US disclosed
EP-2450025-A1 Polymerisable phosphoric acid derivatives comprising a polyalicyclic structure element VOCO GmbH (DE) 2012-05-09 EP disclosed
US-7781124-B2 Hologram recording material NITTO DENKO CORPORATION (JP) 2010-08-24 US disclosed
EP-1721949-B1 Adhesive with improved adhesive strength for polymerisable composition VOCO GMBH (DE) 2010-06-16 EP disclosed
US-5061184-A Fluorine-containing acrylic esters; dentistry DAIKIN INDUSTRIES, LTD. (JP) 1991-10-29 US disclosed
JP-H02238002-A PHOTOSENSITIVE COMPOSITION NIPPON PAINT CO LTD 1990-09-20 JP disclosed
EP-0386780-A2 Photosensitive composition NIPPON PAINT CO., LTD. (JP) 1990-09-12 EP disclosed
EP-0310919-A2 Adhesive composition for biomaterial use DAIKIN INDUSTRIES, LIMITED (JP) 1989-04-12 EP disclosed
EP-0141324-B1 ADHESION PROMOTING AGENT, PROCESS FOR ITS PREPARATION AND USE THEREOF ON COLLAGENEOUS MATERIAL BAYER AG (DE) 1988-06-29 EP disclosed
US-4593054-A Dentistry BAYER AKTIENGESELLSCHAFT (DE) 1986-06-03 US disclosed
EP-0141324-A2 Adhesion promoting agent, process for its preparation and use thereof on collageneous material BAYER AG (DE) 1985-05-15 EP disclosed
US-4373035-A Isotonic monomer formulations AMERICAN DENTAL ASSOCIATION HEALTH FOUNDATION (US) 1983-02-08 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 (1 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-20120115108-A1 POLYMERIZABLE PHOSPHORIC ACID DERIVATIVES COMPRISING A POLYALICYLIC STRUCTURE ELEMENT CAD, PCBP1, PPIP5K2 GPR174 3306/4885TDP1 1760/4885ABCB1 4206/4885

“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.