SCHEMBL20168374

SCHEMBL20168374

NCc1ccc(C2OCCCO2)cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LOXL2 Q9Y4K0 5/20 0.38
ABAT P80404 1/20 0.37
CA2 P00918 1/20 0.35
NCF1 P14598 1/20 0.35
CHKA P35790 1/20 0.35
PRMT6 Q96LA8 1/20 0.35
LTA4H P09960 1/20 0.35
TAAR1 Q96RJ0 2/20 0.34
CSNK2A1 P68400 2/20 0.33
F10 P00742 1/20 0.32
F11 P03951 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
SCHEMBL1680897 0.92 HRH3 (0.42) HRH3LOXL2ABATCA2LTA4H
SCHEMBL9451018 0.82 MEN1 (0.41) ALDH1A1HTTSMN1; SMN2
SCHEMBL31139228 0.80 CHKA (0.39) ALDH1A1HTTSMN1; SMN2CA2CHKA
SCHEMBL11941549 0.80 SMN1; SMN2 (0.51) ALDH1A1HTTSMN1; SMN2TAAR1
SCHEMBL6224572 0.77 CA2 (0.42) HRH3ALDH1A1HTTSMN1; SMN2CA2
SCHEMBL8323459 0.77 PTGES2 (0.45) HRH3LOXL2ABATLTA4HCSNK2A1
SCHEMBL6236362 0.77 MEN1 (0.36) ALDH1A1HTT
SCHEMBL8804519 0.76 TAAR1 (0.43) ALDH1A1SMN1; SMN2LOXL2TAAR1
SCHEMBL5604860 0.73 NCF1 (0.44) ALDH1A1HTTSMN1; SMN2LOXL2NCF1
SCHEMBL16710757 0.73 SOAT1 (0.38) HRH3SMN1; SMN2LOXL2ABATLTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3541368-B1 IMAGEABLE PARTICLES, METHODS OF MAKING AND METHODS OF USE THEREOF US HEALTH (US) 2023-07-12 EP disclosed
EP-3541368-B1 IMAGEABLE PARTICLES, METHODS OF MAKING AND METHODS OF USE THEREOF US HEALTH (US) 2023-07-12 EP disclosed
US-11382990-B2 Imageable polymers, methods of making and methods of use thereof THE USA, AS REPRESENTED BY THE SECRETARY, DHHS (US) 2022-07-12 US disclosed
US-11382990-B2 Imageable polymers, methods of making and methods of use thereof THE USA, AS REPRESENTED BY THE SECRETARY, DHHS (US) 2022-07-12 US disclosed
US-20200197540-A1 Imageable Polymers, Methods of Making and Methods of Use Thereof THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2020-06-25 US disclosed
US-20200197540-A1 Imageable Polymers, Methods of Making and Methods of Use Thereof THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2020-06-25 US disclosed
EP-3541368-A1 IMAGEABLE PARTICLES, METHODS OF MAKING AND METHODS OF USE THEREOF The United States of America, as represented by the Secretary, Department of Health and Human Services (US) 2019-09-25 EP disclosed
WO-2018093566-A1 IMAGEABLE PARTICLES, METHODS OF MAKING AND METHODS OF USE THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2018-05-24 WO disclosed
WO-2018093566-A1 IMAGEABLE PARTICLES, METHODS OF MAKING AND METHODS OF USE THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2018-05-24 WO 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-11382990-B2 Imageable polymers, methods of making and methods of use thereof PUF60, PBRM1, PCBP1 HRH3 1519/4885ALDH1A1 4268/4885HTT 3448/4885
US-20200197540-A1 Imageable Polymers, Methods of Making and Methods of Use Thereof PUF60, PBRM1, PCBP1 HRH3 1519/4885ALDH1A1 4268/4885HTT 3448/4885

“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.