SCHEMBL4198019

SCHEMBL4198019

[CH2]CCCOC(=O)CC(C)C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38
MMP9 P14780 1/20 0.38
MMP13 P45452 1/20 0.38
NAAA Q02083 1/20 0.36
DPP4 P27487 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
ALDH1A1 P00352 1/20 0.36
PRKCA P17252 1/20 0.35
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CA2 P00918 1/20 0.33

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
SCHEMBL2900644 0.87 MMP1 (0.41) MMP1MMP2MMP3MMP9MMP13
SCHEMBL18378814 0.82 MMP1 (0.46) MMP1MMP2MMP3MMP9MMP13
SCHEMBL2529030 0.81 MMP1 (0.39) MMP1MMP2MMP3MMP9MMP13
SCHEMBL2529024 0.81 MMP1 (0.39) MMP1MMP2MMP3MMP9MMP13
SCHEMBL1866046 0.81 ALDH1A1 (0.52) NAAATDP1ALDH1A1MAPTMAPK1
SCHEMBL18338892 0.81 MMP1 (0.39) MMP1MMP2MMP3MMP9MMP13
SCHEMBL95383 0.81 ALDH1A1 (0.52) NAAATDP1ALDH1A1MAPTMAPK1
SCHEMBL2531293 0.79 NAAA (0.41) MMP1MMP2MMP3MMP9MMP13
SCHEMBL17891962 0.79 RARB (0.42) MMP1MMP2MMP3MMP9MMP13
SCHEMBL28864168 0.79 CYP1A2 (0.41) MMP1MMP2MMP3MMP9MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11591426-B2 Copolymer, wetting agent, medical device, and method for producing same TORAY INDUSTRIES, INC. (JP) 2023-02-28 US disclosed
EP-3438144-B1 COPOLYMER, WETTING AGENT, MEDICAL DEVICE, AND METHOD FOR PRODUCING SAME TORAY INDUSTRIES (JP) 2021-06-30 EP disclosed
US-20210015960-A1 COPOLYMER, WETTING AGENT, MEDICAL DEVICE, AND METHOD FOR PRODUCING SAME TORAY INDUSTRIES, INC. (JP) 2021-01-21 US disclosed
US-20190099511-A1 COPOLYMER, WETTING AGENT, MEDICAL DEVICE, AND METHOD FOR PRODUCING SAME TORAY INDUSTRIES, INC. (JP) 2019-04-04 US disclosed
EP-3438144-A1 COPOLYMER, WETTING AGENT, MEDICAL DEVICE, AND METHOD FOR PRODUCING SAME Toray Industries, Inc. (JP) 2019-02-06 EP disclosed
US-20090076147-A1 COMPLEX PANTOIC ACID ESTER NEOPENTYL SULFONYL ESTER CYCLIZATION RELEASE PRODRUGS OF ACAMPROSATE, COMPOSITIONS THEREOF, AND METHODS OF USE XENOPORT, INC. 2009-03-19 US disclosed
US-20090009852-A1 ELECTROPHORETIC PARTICLES AND PROCESSES FOR THE PRODUCTION THEREOF E INK CORPORATION (US) 2009-01-08 US disclosed
US-7411720-B2 Electrophoretic particles and processes for the production thereof E INK CORPORATION (US) 2008-08-12 US disclosed
US-20070128352-A1 ELECTROPHORETIC PARTICLES AND PROCESSES FOR THE PRODUCTION THEREOF E INK CORPORATION (US) 2007-06-07 US disclosed
EP-0721454-A1 NEW PYRAZOLE DERIVATIVES AS ANGIOTENSIN II ANTAGONIST J. URIACH & CIA. S.A. (ES) 1996-07-17 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 (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-20090076147-A1 COMPLEX PANTOIC ACID ESTER NEOPENTYL SULFONYL ESTER CYCLIZATION RELEASE PRODRUGS OF ACAMPROSATE, COMPOSITIONS THEREOF, AND METHODS OF USE ADSL, SLC19A1, SLC25A21 MMP1 3530/4885MMP2 2658/4885MMP3 2183/4885

“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.